N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide CAS Name: N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)Cl)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20ClN3O2S/c1-3-12-25-20(27)17-6-4-5-7-18(17)24-21(25)28-13-19(26)23-14(2)15-8-10-16(22)11-9-15/h3-11,14H,1,12-13H2,2H3,(H,23,26)/t14-/m1/s1