N-[[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]methylideneamino]-2-(4-methoxyphenyl)sulfanyl-ethanamide

Systemtic Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxidanylidene-quinazolin-3-yl)pyrrol-3-yl]methylideneamino]-2-(4-methoxyphenyl)sulfanyl-ethanamide Openeye Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-quinazolin-3-yl)pyrrol-3-yl]methyleneamino]-2-(4-methoxyphenyl)sulfanyl-acetamide CAS Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxo-3-quinazolinyl)-3-pyrrolyl]methylideneamino]-2-[(4-methoxyphenyl)thio]acetamide IUPAC Name: N-[[2,5-dimethyl-1-(2-methyl-4-oxoquinazolin-3-yl)pyrrol-3-yl]methylideneamino]-2-(4-methoxyphenyl)sulfanylacetamide Traditional Name: N-[[1-(4-keto-2-methyl-quinazolin-3-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-[(4-methoxyphenyl)thio]acetamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=NNC(=O)CSC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(N1N2C(=NC3=CC=CC=C3C2=O)C)C)C=NNC(=O)CSC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H25N5O3S/c1-16-13-19(14-26-28-24(31)15-34-21-11-9-20(33-4)10-12-21)17(2)29(16)30-18(3)27-23-8-6-5-7-22(23)25(30)32/h5-14H,15H2,1-4H3,(H,28,31)