69736146 -OEChem-03282416422D 45 48 0 1 0 0 0 0 0999 V2000 6.3404 -3.0393 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4573 1.4051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0812 3.1373 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.0271 0.6731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3556 -3.3879 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8224 2.1714 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4497 1.5794 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3446 4.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2213 1.6626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1077 2.5191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4801 2.6285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0309 0.5859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6082 -0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1818 -1.1396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6121 -0.4076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7592 -2.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1894 -1.3139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 -2.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3442 -3.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7706 -2.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9216 -4.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7744 -2.3945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9254 -4.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3518 -3.3008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6024 1.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8816 1.1346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6624 4.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7314 4.2119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0264 1.0740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8153 1.4848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9134 3.1078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5219 2.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0741 2.4507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6751 3.2171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3827 0.1652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7995 -1.0855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2564 0.1003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1148 -2.5537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5718 -1.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0326 -1.7454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2772 -4.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4188 -1.8866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6634 -4.6818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0936 -3.9498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 12 2 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 35 1 0 0 0 0 5 24 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 25 1 1 0 0 0 7 10 1 0 0 0 0 7 26 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 37 1 0 0 0 0 16 18 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 M END > 69736146 > 1 > 444 > 4 > 2 > 4 > AAADceB7IABAAAAAAAAAAAAAAAAAAWLAAAA8YIAAAAAAAAABQAAAHgQQAAAADSjB2AQwwYPAAAiIAiVSUACCAAAkChAIiJkIZMgIYDKg1ZGUIQhglgCoyYcYiACOEAQAAAAAAAAgCAAAAAAAAAAAAAAAAA== > 4-(4-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-[(4-aminophenyl)thio]-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(4-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(4-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(4-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-[(4-aminophenyl)thio]-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > InChI=1S/C19H21N3OS/c20-15-3-7-17(8-4-15)24-16-5-1-13(2-6-16)19(23)21-18-12-22-10-9-14(18)11-22/h1-8,14,18H,9-12,20H2,(H,21,23)/t14-,18?/m0/s1 > YIILYQCQTUQMMQ-PIVQAISJSA-N > 2.9 > 339.14053348 > C19H21N3OS > 339.5 > C1CN2CC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(C=C4)N > C1CN2C[C@H]1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=C(C=C4)N > 83.7 > 339.14053348 > 0 > 24 > 1 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 13 14 8 13 15 8 14 16 8 15 17 8 16 18 8 17 18 8 19 20 8 19 21 8 20 22 8 21 23 8 22 24 8 23 24 8 7 4 3 6 25 5 $$$$