2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(cyclopentylcarbamoyl)ethanamide

Systemtic Name: 2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(cyclopentylcarbamoyl)ethanamide Openeye Name: 2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide CAS Name: 2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[(cyclopentylamino)-oxomethyl]acetamide IUPAC Name: 2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(cyclopentylcarbamoyl)acetamide Traditional Name: 2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]-N-(cyclopentylcarbamoyl)acetamide Formula: C19H21ClN4O3S MolecularWeight: 420.91304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC(=O)NC3CCCC3

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC(=O)NC3CCCC3

InChI

InChI=1S/C19H21ClN4O3S/c1-2-9-24-17(26)14-10-12(20)7-8-15(14)22-19(24)28-11-16(25)23-18(27)21-13-5-3-4-6-13/h2,7-8,10,13H,1,3-6,9,11H2,(H2,21,23,25,27)