2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-phenylbutyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-(2-phenylbutyl)acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(2-phenylbutyl)acetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-(2-phenylbutyl)acetamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

InChI

InChI=1S/C23H24ClN3O2S/c1-3-12-27-22(29)19-11-10-18(24)13-20(19)26-23(27)30-15-21(28)25-14-16(4-2)17-8-6-5-7-9-17/h3,5-11,13,16H,1,4,12,14-15H2,2H3,(H,25,28)