7,8-dimethoxy-3-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 7,8-dimethoxy-3-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 7,8-dimethoxy-3-[(E)-(4-methylsulfanylphenyl)methyleneamino]-5H-pyrimido[5,4-b]indol-4-one CAS Name: 7,8-dimethoxy-3-[(E)-[4-(methylthio)phenyl]methylideneamino]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 7,8-dimethoxy-3-[(E)-(4-methylsulfanylphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 7,8-dimethoxy-3-[(E)-[4-(methylthio)benzylidene]amino]-5H-pyrimid[5,4-b]indol-4-one Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=C(N2)C(=O)N(C=N3)N=CC4=CC=C(C=C4)SC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=C(N2)C(=O)N(C=N3)/N=C/C4=CC=C(C=C4)SC)OC

InChI

InChI=1S/C20H18N4O3S/c1-26-16-8-14-15(9-17(16)27-2)23-19-18(14)21-11-24(20(19)25)22-10-12-4-6-13(28-3)7-5-12/h4-11,23H,1-3H3/b22-10+