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

Systemtic Name: N-cyclohexyl-4-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Openeye Name: N-cyclohexyl-4-(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)butanamide CAS Name: N-cyclohexyl-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide IUPAC Name: N-cyclohexyl-4-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)butanamide Traditional Name: N-cyclohexyl-4-(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)butyramide 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)CCCC(=O)NC3CCCCC3)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCC(=O)NC3CCCCC3)OCC

InChI

InChI=1S/C22H31N3O4S/c1-3-28-18-13-16-17(14-19(18)29-4-2)24-22(30)25(21(16)27)12-8-11-20(26)23-15-9-6-5-7-10-15/h13-15H,3-12H2,1-2H3,(H,23,26)(H,24,30)