1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione

Systemtic Name: 1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione Openeye Name: 1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione CAS Name: 1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione IUPAC Name: 1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione Traditional Name: 1-(4-bromophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepine-4-thione Formula: C17H15BrN2O2S MolecularWeight: 391.2822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(=S)NN=C2C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(=S)NN=C2C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C17H15BrN2O2S/c1-21-14-7-11-8-16(23)19-20-17(13(11)9-15(14)22-2)10-3-5-12(18)6-4-10/h3-7,9H,8H2,1-2H3,(H,19,23)