N-[4-[2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-3-fluoranyl-phenyl]ethanamide

Systemtic Name: N-[4-[2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]-3-fluoranyl-phenyl]ethanamide Openeye Name: N-[4-[2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanylacetyl]-3-fluoro-phenyl]acetamide CAS Name: N-[4-[2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-1-oxoethyl]-3-fluorophenyl]acetamide IUPAC Name: N-[4-[2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]-3-fluorophenyl]acetamide Traditional Name: N-[4-[2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]acetyl]-3-fluoro-phenyl]acetamide Formula: C21H17ClFN3O3S MolecularWeight: 445.894383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C)F

InChI

InChI=1S/C21H17ClFN3O3S/c1-3-8-26-20(29)16-9-13(22)4-7-18(16)25-21(26)30-11-19(28)15-6-5-14(10-17(15)23)24-12(2)27/h3-7,9-10H,1,8,11H2,2H3,(H,24,27)