7-methyl-4-(4-methylsulfanylphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 7-methyl-4-(4-methylsulfanylphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 7-methyl-4-(4-methylsulfanylphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 7-methyl-4-[4-(methylthio)phenyl]-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 7-methyl-4-(4-methylsulfanylphenyl)-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 7-methyl-4-[4-(methylthio)phenyl]-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C20H20N2S MolecularWeight: 320.4512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CNC(C3=CC=CN3C2=CC=C1)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=C2CNC(C3=CC=CN3C2=CC=C1)C4=CC=C(C=C4)SC

InChI

InChI=1S/C20H20N2S/c1-14-5-3-6-18-17(14)13-21-20(19-7-4-12-22(18)19)15-8-10-16(23-2)11-9-15/h3-12,20-21H,13H2,1-2H3