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

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(cyclohexen-1-yl)ethyl]propanamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-[2-(cyclohexen-1-yl)ethyl]propionamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C22H27N3O2S/c1-3-15-25-21(27)18-11-7-8-12-19(18)24-22(25)28-16(2)20(26)23-14-13-17-9-5-4-6-10-17/h3,7-9,11-12,16H,1,4-6,10,13-15H2,2H3,(H,23,26)