4-[(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide

Systemtic Name: 4-[(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide Openeye Name: 4-[(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide CAS Name: 4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide IUPAC Name: 4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide Traditional Name: 4-[(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)methyl]-N-(2,3-dimethylcyclohexyl)benzamide Formula: C28H35N3O4S MolecularWeight: 509.6602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)C(=O)NC4CCCC(C4C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CC3=CC=C(C=C3)C(=O)NC4CCCC(C4C)C)OCC

InChI

InChI=1S/C28H35N3O4S/c1-5-34-24-14-21-23(15-25(24)35-6-2)30-28(36)31(27(21)33)16-19-10-12-20(13-11-19)26(32)29-22-9-7-8-17(3)18(22)4/h10-15,17-18,22H,5-9,16H2,1-4H3,(H,29,32)(H,30,36)