N-(3-acetamidophenyl)-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-acetamidophenyl)-2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-acetamidophenyl)-2-(7-chloro-3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3-acetamidophenyl)-2-[(7-chloro-3-cyclohexyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3-acetamidophenyl)-2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetamidophenyl)-2-[(7-chloro-3-cyclohexyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C24H25ClN4O3S MolecularWeight: 484.9983

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4CCCCC4

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4CCCCC4

InChI

InChI=1S/C24H25ClN4O3S/c1-15(30)26-17-6-5-7-18(13-17)27-22(31)14-33-24-28-21-12-16(25)10-11-20(21)23(32)29(24)19-8-3-2-4-9-19/h5-7,10-13,19H,2-4,8-9,14H2,1H3,(H,26,30)(H,27,31)