2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(2-phenylpropyl)propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC=C)C3=CC=CC=C3

InChI

InChI=1S/C23H24ClN3O2S/c1-4-12-27-22(29)19-11-10-18(24)13-20(19)26-23(27)30-16(3)21(28)25-14-15(2)17-8-6-5-7-9-17/h4-11,13,15-16H,1,12,14H2,2-3H3,(H,25,28)