(4E)-4-[(4-methoxyphenyl)methylidene]-6-methyl-2-methylsulfanyl-1H-imidazo[4,5-d]azepin-5-one

Systemtic Name: (4E)-4-[(4-methoxyphenyl)methylidene]-6-methyl-2-methylsulfanyl-1H-imidazo[4,5-d]azepin-5-one Openeye Name: (4E)-4-[(4-methoxyphenyl)methylene]-6-methyl-2-methylsulfanyl-1H-imidazo[4,5-d]azepin-5-one CAS Name: (4E)-4-[(4-methoxyphenyl)methylidene]-6-methyl-2-(methylthio)-1H-imidazo[4,5-d]azepin-5-one IUPAC Name: (4E)-4-[(4-methoxyphenyl)methylidene]-6-methyl-2-methylsulfanyl-1H-imidazo[4,5-d]azepin-5-one Traditional Name: (4E)-6-methyl-2-(methylthio)-4-p-anisylidene-1H-imidaz[4,5-d]azepin-5-one Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C(C(=CC3=CC=C(C=C3)OC)C1=O)N=C(N2)SC

Isomeric SMILES

CN1C=CC2=C(/C(=C\C3=CC=C(C=C3)OC)/C1=O)N=C(N2)SC

InChI

InChI=1S/C17H17N3O2S/c1-20-9-8-14-15(19-17(18-14)23-3)13(16(20)21)10-11-4-6-12(22-2)7-5-11/h4-10H,1-3H3,(H,18,19)/b13-10+