2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[2-(1-cyclohexenyl)ethyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]acetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-[2-(cyclohexen-1-yl)ethyl]acetamide Formula: C21H24ClN3O2S MolecularWeight: 417.95216

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCCC3=CCCCC3

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NCCC3=CCCCC3

InChI

InChI=1S/C21H24ClN3O2S/c1-2-12-25-20(27)17-9-8-16(22)13-18(17)24-21(25)28-14-19(26)23-11-10-15-6-4-3-5-7-15/h2,6,8-9,13H,1,3-5,7,10-12,14H2,(H,23,26)