4-(4-bromophenyl)-2-methylsulfanyl-7-phenylsulfanyl-3H-1,5-benzodiazepine

Systemtic Name: 4-(4-bromophenyl)-2-methylsulfanyl-7-phenylsulfanyl-3H-1,5-benzodiazepine Openeye Name: 4-(4-bromophenyl)-2-methylsulfanyl-7-phenylsulfanyl-3H-1,5-benzodiazepine CAS Name: 4-(4-bromophenyl)-2-(methylthio)-7-(phenylthio)-3H-1,5-benzodiazepine IUPAC Name: 4-(4-bromophenyl)-2-methylsulfanyl-7-phenylsulfanyl-3H-1,5-benzodiazepine Traditional Name: 4-(4-bromophenyl)-2-(methylthio)-7-(phenylthio)-3H-1,5-benzodiazepine Formula: C22H17BrN2S2 MolecularWeight: 453.41778

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=C(C=C2)SC3=CC=CC=C3)N=C(C1)C4=CC=C(C=C4)Br

Isomeric SMILES

CSC1=NC2=C(C=C(C=C2)SC3=CC=CC=C3)N=C(C1)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2S2/c1-26-22-14-20(15-7-9-16(23)10-8-15)24-21-13-18(11-12-19(21)25-22)27-17-5-3-2-4-6-17/h2-13H,14H2,1H3