3-[(4-chlorophenyl)methyl]-N-(2,2-dimethoxyethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-[(4-chlorophenyl)methyl]-N-(2,2-dimethoxyethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-[(4-chlorophenyl)methyl]-N-(2,2-dimethoxyethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-[(4-chlorophenyl)methyl]-N-(2,2-dimethoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-[(4-chlorophenyl)methyl]-N-(2,2-dimethoxyethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(4-chlorobenzyl)-N-(2,2-dimethoxyethyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC(CNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O4S/c1-27-17(28-2)10-22-18(25)13-5-8-15-16(9-13)23-20(29)24(19(15)26)11-12-3-6-14(21)7-4-12/h3-9,17H,10-11H2,1-2H3,(H,22,25)(H,23,29)