N-[(3-methoxyphenyl)methyl]-1-methyl-3-[(4-methylsulfanylphenyl)methyl]-2-oxidanylidene-4H-quinazoline-6-carboxamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-1-methyl-3-[(4-methylsulfanylphenyl)methyl]-2-oxidanylidene-4H-quinazoline-6-carboxamide Openeye Name: N-[(3-methoxyphenyl)methyl]-1-methyl-3-[(4-methylsulfanylphenyl)methyl]-2-oxo-4H-quinazoline-6-carboxamide CAS Name: N-[(3-methoxyphenyl)methyl]-1-methyl-3-[[4-(methylthio)phenyl]methyl]-2-oxo-4H-quinazoline-6-carboxamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-1-methyl-3-[(4-methylsulfanylphenyl)methyl]-2-oxo-4H-quinazoline-6-carboxamide Traditional Name: 2-keto-N-m-anisyl-1-methyl-3-[4-(methylthio)benzyl]-4H-quinazoline-6-carboxamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)SC)C=C(C=C2)C(=O)NCC4=CC(=CC=C4)OC

Isomeric SMILES

CN1C2=C(CN(C1=O)CC3=CC=C(C=C3)SC)C=C(C=C2)C(=O)NCC4=CC(=CC=C4)OC

InChI

InChI=1S/C26H27N3O3S/c1-28-24-12-9-20(25(30)27-15-19-5-4-6-22(13-19)32-2)14-21(24)17-29(26(28)31)16-18-7-10-23(33-3)11-8-18/h4-14H,15-17H2,1-3H3,(H,27,30)