3-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propanamide

Systemtic Name: 3-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propanamide Openeye Name: 3-(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propanamide CAS Name: 3-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propanamide IUPAC Name: 3-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propanamide Traditional Name: 3-(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(2-methylcyclohexyl)propionamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3CCCCC3C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3CCCCC3C)OCC

InChI

InChI=1S/C22H31N3O4S/c1-4-28-18-12-15-17(13-19(18)29-5-2)24-22(30)25(21(15)27)11-10-20(26)23-16-9-7-6-8-14(16)3/h12-14,16H,4-11H2,1-3H3,(H,23,26)(H,24,30)