24418559 -OEChem-05142415532D 56 59 0 0 0 0 0 0 0999 V2000 3.6067 2.8089 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -5.6604 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -5.5799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9854 0.9078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -0.5808 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 0.3698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2496 4.5037 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 3.9656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.8850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -4.8356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.0803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -5.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -4.2975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -5.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 -4.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -6.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 -5.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9639 1.1141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2746 2.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5602 5.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 4.9161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 3.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5387 5.6604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8924 6.1985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1851 5.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -3.7003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8819 -3.0803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -2.4603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5956 -1.1972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -3.7082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -6.4538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0279 -4.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4492 -6.7878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2384 0.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8215 1.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6571 2.5525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7313 6.2498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3538 6.6126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4783 6.6600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4309 5.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3129 4.5157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7917 5.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0572 5.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 31 1 0 0 0 0 2 26 1 0 0 0 0 3 16 2 0 0 0 0 4 27 2 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 18 2 0 0 0 0 7 27 1 0 0 0 0 7 47 1 0 0 0 0 8 29 2 0 0 0 0 8 31 1 0 0 0 0 9 30 1 0 0 0 0 9 31 2 0 0 0 0 10 12 2 0 0 0 0 10 16 1 0 0 0 0 11 13 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 14 35 1 0 0 0 0 15 20 2 0 0 0 0 15 36 1 0 0 0 0 16 21 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 32 1 0 0 0 0 29 33 1 0 0 0 0 30 32 2 0 0 0 0 30 34 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 M END > 24418559 > 1 > 737 > 7 > 1 > 7 > AAADceB7sQBAAAAAAAAAAAAAAAAAAWAAAAA8WIAAAAAAAFgB/AAAHwQYAAAADAzF3gy/0LduGAioA7V3dACS0Cl3ArAb2CG4ZNiIKPLA3fGEJQhomALIyacYicCegAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-[3-(4-fluorobenzoyl)-2-methyl-indolizin-1-yl]methyleneamino]acetamide > 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[(E)-[3-[(4-fluorophenyl)-oxomethyl]-2-methyl-1-indolizinyl]methylideneamino]acetamide > 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-[3-(4-fluorobenzoyl)-2-methylindolizin-1-yl]methylideneamino]acetamide > 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-[3-(4-fluorobenzoyl)-2-methylindolizin-1-yl]methylideneamino]acetamide > 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[(E)-[3-(4-fluorophenyl)carbonyl-2-methyl-indolizin-1-yl]methylideneamino]ethanamide > 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-[(E)-[3-(4-fluorobenzoyl)-2-methyl-indolizin-1-yl]methyleneamino]acetamide > InChI=1S/C25H22FN5O2S/c1-15-12-16(2)29-25(28-15)34-14-22(32)30-27-13-20-17(3)23(31-11-5-4-6-21(20)31)24(33)18-7-9-19(26)10-8-18/h4-13H,14H2,1-3H3,(H,30,32)/b27-13+ > GFIAJLHVSUTXEF-UVHMKAGCSA-N > 5.5 > 475.14782430 > C25H22FN5O2S > 475.5 > CC1=CC(=NC(=N1)SCC(=O)NN=CC2=C3C=CC=CN3C(=C2C)C(=O)C4=CC=C(C=C4)F)C > CC1=CC(=NC(=N1)SCC(=O)N/N=C/C2=C3C=CC=CN3C(=C2C)C(=O)C4=CC=C(C=C4)F)C > 114 > 475.14782430 > 0 > 34 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 10 12 8 11 13 8 11 15 8 12 13 8 14 19 8 15 20 8 19 20 8 21 22 8 21 23 8 22 24 8 23 25 8 24 26 8 25 26 8 29 32 8 30 32 8 5 10 8 5 11 8 5 14 8 8 29 8 8 31 8 9 30 8 9 31 8 $$$$