N-[(3-chlorophenyl)methyl]-3-(5,6-dimethoxypyridin-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-3-(5,6-dimethoxypyridin-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-3-(5,6-dimethoxy-2-pyridyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-3-(5,6-dimethoxy-2-pyridinyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-3-(5,6-dimethoxypyridin-2-yl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-chlorobenzyl)-3-(5,6-dimethoxy-2-pyridyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H19ClN4O4S MolecularWeight: 482.93936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(N=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC(=CC=C4)Cl)NC2=S)OC

Isomeric SMILES

COC1=C(N=C(C=C1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC(=CC=C4)Cl)NC2=S)OC

InChI

InChI=1S/C23H19ClN4O4S/c1-31-18-8-9-19(27-21(18)32-2)28-22(30)16-7-6-14(11-17(16)26-23(28)33)20(29)25-12-13-4-3-5-15(24)10-13/h3-11H,12H2,1-2H3,(H,25,29)(H,26,33)