90455046 -OEChem-09272320552D 57 61 0 0 0 0 0 0 0999 V2000 4.0949 -0.1966 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9704 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.9704 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.9704 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.0281 1.4704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -0.0296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 1.4704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4384 0.1657 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8319 1.4704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.0220 0.9704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2960 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1620 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2960 1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0281 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1620 1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8941 1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7601 1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6261 1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7601 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4922 1.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6979 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4922 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6261 -0.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6261 2.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4384 1.7752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8319 0.4704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4887 -1.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0220 0.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -1.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6979 1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0220 0.9704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7591 0.7804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7635 -0.5045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5606 -0.5045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 2.0531 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6854 1.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2401 -0.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6386 0.5781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5606 2.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7635 2.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2926 2.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4956 2.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -0.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2232 0.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6261 -0.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2461 2.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6261 3.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0061 2.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6310 2.3645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9028 -1.4628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6310 -0.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6979 2.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8923 -2.5810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5826 -2.1825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 30 1 0 0 0 0 2 33 1 0 0 0 0 3 33 1 0 0 0 0 4 33 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 6 11 1 0 0 0 0 6 18 1 0 0 0 0 6 46 1 0 0 0 0 7 18 1 0 0 0 0 7 31 2 0 0 0 0 8 23 1 0 0 0 0 8 29 1 0 0 0 0 8 54 1 0 0 0 0 9 27 2 0 0 0 0 9 31 1 0 0 0 0 10 34 3 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 15 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 22 2 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 20 24 2 0 0 0 0 20 47 1 0 0 0 0 21 23 2 0 0 0 0 21 26 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 29 2 0 0 0 0 26 52 1 0 0 0 0 28 30 2 0 0 0 0 28 53 1 0 0 0 0 29 34 1 0 0 0 0 30 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END > 90455046 > 1 > 751 > 9 > 2 > 5 > AAADceB7gYBAAAAAAAAAAAAAAAAAAWJAAAA8WIAAAAAAAFgB/gAAHQQQAAAADCjBXhQ38ffJkAi0ByZjZACj0KlxCrhJ2bg4ZJiIqOLg2dGEJAxokALoyC8QgMAOiAACQAASAAAQAASAACQAAAAAAAAAAA== > 4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]-1-piperidyl]methyl]-1H-indole-2-carbonitrile > 4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)-4-thieno[2,3-d]pyrimidinyl]amino]-1-piperidinyl]methyl]-1H-indole-2-carbonitrile > 4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-1H-indole-2-carbonitrile > 4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-1H-indole-2-carbonitrile > 4-methyl-5-[[4-[[6-[2,2,2-tris(fluoranyl)ethyl]thieno[2,3-d]pyrimidin-4-yl]amino]piperidin-1-yl]methyl]-1H-indole-2-carbonitrile > 4-methyl-5-[[4-[[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino]piperidino]methyl]-1H-indole-2-carbonitrile > InChI=1S/C24H23F3N6S/c1-14-15(2-3-21-19(14)8-17(11-28)31-21)12-33-6-4-16(5-7-33)32-22-20-9-18(10-24(25,26)27)34-23(20)30-13-29-22/h2-3,8-9,13,16,31H,4-7,10,12H2,1H3,(H,29,30,32) > DZACSLYTXLZAAF-UHFFFAOYSA-N > 5.9 > 484.16570042 > C24H23F3N6S > 484.5 > CC1=C(C=CC2=C1C=C(N2)C#N)CN3CCC(CC3)NC4=C5C=C(SC5=NC=N4)CC(F)(F)F > CC1=C(C=CC2=C1C=C(N2)C#N)CN3CCC(CC3)NC4=C5C=C(SC5=NC=N4)CC(F)(F)F > 109 > 484.16570042 > 0 > 34 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 27 8 1 30 8 17 19 8 17 20 8 18 22 8 19 21 8 20 24 8 21 23 8 21 26 8 22 27 8 22 28 8 23 24 8 26 29 8 28 30 8 7 18 8 7 31 8 8 23 8 8 29 8 9 27 8 9 31 8 $$$$