4-(4-methoxyphenyl)-1-methylsulfanyl-5H-2,3-benzodiazepine

Systemtic Name: 4-(4-methoxyphenyl)-1-methylsulfanyl-5H-2,3-benzodiazepine Openeye Name: 4-(4-methoxyphenyl)-1-methylsulfanyl-5H-2,3-benzodiazepine CAS Name: 4-(4-methoxyphenyl)-1-(methylthio)-5H-2,3-benzodiazepine IUPAC Name: 4-(4-methoxyphenyl)-1-methylsulfanyl-5H-2,3-benzodiazepine Traditional Name: 4-(4-methoxyphenyl)-1-(methylthio)-5H-2,3-benzodiazepine Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C3C2)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C3C2)SC

InChI

InChI=1S/C17H16N2OS/c1-20-14-9-7-12(8-10-14)16-11-13-5-3-4-6-15(13)17(21-2)19-18-16/h3-10H,11H2,1-2H3