115208 -OEChem-03282419002D 48 51 0 1 0 0 0 0 0999 V2000 2.1490 -1.8437 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7069 1.3121 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9504 -3.6474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7957 -1.5244 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.8208 0.5001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2085 -1.9347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8208 -1.3019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3869 -0.4009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1973 -2.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5776 -0.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5776 0.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7957 0.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0183 -2.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4715 -1.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4715 0.6338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0183 1.6975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3776 -0.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3776 0.1199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 -2.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9738 1.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2852 2.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5962 -2.5674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1964 2.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5077 3.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4633 3.6474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8944 -3.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1355 -1.6799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0256 -1.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9022 -0.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9022 -0.7875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -2.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7418 -2.3802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4138 -2.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1562 -3.1038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6227 -2.3614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4644 -2.0555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 -1.3575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4644 1.2537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9133 -1.2338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9133 0.4320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6928 2.1949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7888 3.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0532 3.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6013 4.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9959 -3.8914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4129 -1.1254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4497 -3.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 20 1 0 0 0 0 3 19 2 0 0 0 0 4 7 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 8 1 0 0 0 0 5 12 2 0 0 0 0 6 9 1 0 0 0 0 6 19 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 16 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 17 1 0 0 0 0 14 37 1 0 0 0 0 15 18 1 0 0 0 0 15 39 1 0 0 0 0 16 20 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 26 1 0 0 0 0 22 27 2 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 26 28 2 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M END > 115208 > 1 > 586 > 5 > 1 > 4 > AAADceB7IQBAAAAAAAAAAAAAAAAAASAAAAAwYAAABAAAAAAB0AAAHwQQAAAADCjF2AyywYPAAAisAyVyVACDAIAlChBIiJkoZNgIYLLg1ZGUIQhglgDoyYcQgMAOAAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]-3-thiophenecarboxamide > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide > N-[[5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1,4-benzodiazepin-2-yl]methyl]thiophene-3-carboxamide > InChI=1S/C22H20FN3OS/c1-26-16(13-25-22(27)15-10-11-28-14-15)12-24-21(17-6-2-4-8-19(17)23)18-7-3-5-9-20(18)26/h2-11,14,16H,12-13H2,1H3,(H,25,27) > NPGABYHTDVGGJK-UHFFFAOYSA-N > 4 > 393.13111161 > C22H20FN3OS > 393.5 > CN1C(CN=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(=O)C4=CSC=C4 > CN1C(CN=C(C2=CC=CC=C21)C3=CC=CC=C3F)CNC(=O)C4=CSC=C4 > 72.9 > 393.13111161 > 0 > 28 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 1 27 8 1 28 8 10 11 8 10 14 8 11 15 8 14 17 8 15 18 8 16 20 8 16 21 8 17 18 8 20 23 8 21 24 8 22 26 8 22 27 8 23 25 8 24 25 8 26 28 8 7 9 3 $$$$