3-(3,4-dimethoxyphenyl)-N-naphthalen-1-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3,4-dimethoxyphenyl)-N-naphthalen-1-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(3,4-dimethoxyphenyl)-N-(1-naphthyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(3,4-dimethoxyphenyl)-N-(1-naphthalenyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(3,4-dimethoxyphenyl)-N-naphthalen-1-yl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-N-(1-naphthyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C27H21N3O4S MolecularWeight: 483.53834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC=CC5=CC=CC=C54)NC2=S)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC=CC5=CC=CC=C54)NC2=S)OC

InChI

InChI=1S/C27H21N3O4S/c1-33-23-13-11-18(15-24(23)34-2)30-26(32)20-12-10-17(14-22(20)29-27(30)35)25(31)28-21-9-5-7-16-6-3-4-8-19(16)21/h3-15H,1-2H3,(H,28,31)(H,29,35)