(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: (4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl-methyl-[4-(methylthio)benzyl]ammonium Formula: C20H24N3O3S+ MolecularWeight: 386.48786

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C20H23N3O3S/c1-23(11-13-5-7-14(27-4)8-6-13)12-19-21-16-10-18(26-3)17(25-2)9-15(16)20(24)22-19/h5-10H,11-12H2,1-4H3,(H,21,22,24)/p+1