N-(cyclohexen-1-yl)-N-cyclopropyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide CAS Name: N-(1-cyclohexenyl)-N-cyclopropyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(cyclohexen-1-yl)-N-cyclopropyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(cyclohexen-1-yl)-N-cyclopropyl-acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C3CC3)C4=CCCCC4

InChI

InChI=1S/C22H25N3O2S/c1-2-14-24-21(27)18-10-6-7-11-19(18)23-22(24)28-15-20(26)25(17-12-13-17)16-8-4-3-5-9-16/h2,6-8,10-11,17H,1,3-5,9,12-15H2