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

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-[(R)-(4-methylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(R)-p-tolyl(2-thienyl)methyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: (4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl-[(R)-p-tolyl(2-thienyl)methyl]ammonium Formula: C23H24N3O3S+ MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C23H23N3O3S/c1-14-6-8-15(9-7-14)22(20-5-4-10-30-20)24-13-21-25-17-12-19(29-3)18(28-2)11-16(17)23(27)26-21/h4-12,22,24H,13H2,1-3H3,(H,25,26,27)/p+1/t22-/m1/s1