N-(3-ethanoylphenyl)-2-(8-methoxy-3,5-dimethyl-4-oxidanylidene-pyrimido[5,4-b]indol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(8-methoxy-3,5-dimethyl-4-oxidanylidene-pyrimido[5,4-b]indol-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetylphenyl)-2-(8-methoxy-3,5-dimethyl-4-oxo-pyrimido[5,4-b]indol-2-yl)sulfanyl-acetamide CAS Name: N-(3-acetylphenyl)-2-[(8-methoxy-3,5-dimethyl-4-oxo-2-pyrimido[5,4-b]indolyl)thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-(8-methoxy-3,5-dimethyl-4-oxopyrimido[5,4-b]indol-2-yl)sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[(4-keto-8-methoxy-3,5-dimethyl-pyrimid[5,4-b]indol-2-yl)thio]acetamide Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C)N(C4=C3C=C(C=C4)OC)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C(=O)N2C)N(C4=C3C=C(C=C4)OC)C

InChI

InChI=1S/C23H22N4O4S/c1-13(28)14-6-5-7-15(10-14)24-19(29)12-32-23-25-20-17-11-16(31-4)8-9-18(17)26(2)21(20)22(30)27(23)3/h5-11H,12H2,1-4H3,(H,24,29)