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

Systemtic Name: 4-(4-bromophenyl)-7-phenoxy-1,3-dihydro-1,5-benzodiazepine-2-thione Openeye Name: 4-(4-bromophenyl)-7-phenoxy-1,3-dihydro-1,5-benzodiazepine-2-thione CAS Name: 4-(4-bromophenyl)-7-phenoxy-1,3-dihydro-1,5-benzodiazepine-2-thione IUPAC Name: 4-(4-bromophenyl)-7-phenoxy-1,3-dihydro-1,5-benzodiazepine-2-thione Traditional Name: 4-(4-bromophenyl)-7-phenoxy-1,3-dihydro-1,5-benzodiazepine-2-thione Formula: C21H15BrN2OS MolecularWeight: 423.3256

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=CC(=C2)OC3=CC=CC=C3)NC1=S)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C(=NC2=C(C=CC(=C2)OC3=CC=CC=C3)NC1=S)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2OS/c22-15-8-6-14(7-9-15)19-13-21(26)24-18-11-10-17(12-20(18)23-19)25-16-4-2-1-3-5-16/h1-12H,13H2,(H,24,26)