7-bromanyl-3-[(4-bromophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine

Systemtic Name: 7-bromanyl-3-[(4-bromophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine Openeye Name: 7-bromo-3-[(4-bromophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine CAS Name: 7-bromo-3-[(4-bromophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine IUPAC Name: 7-bromo-3-[(4-bromophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-methylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepine Traditional Name: 7-bromo-3-(4-bromobenzyl)-1-(1H-imidazol-5-ylmethyl)-4-mesyl-3,5-dihydro-2H-1,4-benzodiazepine Formula: C21H22Br2N4O2S MolecularWeight: 554.29798

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=C(C=C3)Br)CC4=CN=CN4

Isomeric SMILES

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)N(CC1CC3=CC=C(C=C3)Br)CC4=CN=CN4

InChI

InChI=1S/C21H22Br2N4O2S/c1-30(28,29)27-11-16-9-18(23)6-7-21(16)26(12-19-10-24-14-25-19)13-20(27)8-15-2-4-17(22)5-3-15/h2-7,9-10,14,20H,8,11-13H2,1H3,(H,24,25)