69736115 -OEChem-03282412232D 45 48 0 1 0 0 0 0 0999 V2000 5.4553 -2.3322 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5722 2.1122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1961 3.8444 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.1419 1.3802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6176 -4.3191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9373 2.8785 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5646 2.2865 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4595 4.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3362 2.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2225 3.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5950 3.3356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1457 1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7231 0.3867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2967 -0.4325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7269 0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8741 -1.3388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3043 -0.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8779 -1.4259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4591 -2.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0364 -3.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8855 -1.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0403 -3.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8893 -1.6874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4667 -2.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7173 2.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9965 1.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7773 5.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8463 4.9190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1413 1.7811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9302 2.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0282 3.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6368 3.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1890 3.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7899 3.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4976 0.8723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9143 -0.3784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3713 0.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2297 -1.8466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6867 -0.6608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3921 -3.8336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1475 -1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5337 -1.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -2.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9733 -4.8270 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 22 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 1 0 0 0 0 19 21 2 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 21 23 1 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END > 69736115 > 1 > 452 > 4 > 2 > 4 > AAADceB7IABAAAAAAAAAAAAAAAAAAWLAAAA8YIAAAAAAAAABQAAAHgQQAAAADSjB2AQwwYPAAAiIAiVSUACCAAAkChAIiJkIZMgIYDKg1ZGUIQxglgCoyYcYiACOEAAAACAAAAAgAAAAQAAAAAAAAAAAAA== > 4-(3-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-[(3-aminophenyl)thio]-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(3-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(3-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-(3-aminophenyl)sulfanyl-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > 4-[(3-aminophenyl)thio]-N-[(4S)-1-azabicyclo[2.2.1]heptan-3-yl]benzamide > InChI=1S/C19H21N3OS/c20-15-2-1-3-17(10-15)24-16-6-4-13(5-7-16)19(23)21-18-12-22-9-8-14(18)11-22/h1-7,10,14,18H,8-9,11-12,20H2,(H,21,23)/t14-,18?/m0/s1 > HZJHJNNTDHMJHP-PIVQAISJSA-N > 2.9 > 339.14053348 > C19H21N3OS > 339.5 > C1CN2CC1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=C4)N > C1CN2C[C@H]1C(C2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC(=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 $$$$