N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)-N-methyl-N-[4-(methylthio)benzyl]butyramide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H23N3O2S/c1-24(14-15-10-12-16(27-2)13-11-15)20(25)9-5-8-19-22-18-7-4-3-6-17(18)21(26)23-19/h3-4,6-7,10-13H,5,8-9,14H2,1-2H3,(H,22,23,26)