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

Systemtic Name: N-[3-fluoranyl-4-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl]phenyl]ethanamide Openeye Name: N-[4-[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-3-fluoro-phenyl]acetamide CAS Name: N-[3-fluoro-4-[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]phenyl]acetamide IUPAC Name: N-[3-fluoro-4-[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]phenyl]acetamide Traditional Name: N-[4-[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]-3-fluoro-phenyl]acetamide Formula: C21H18FN3O3S MolecularWeight: 411.449323

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C)F

InChI

InChI=1S/C21H18FN3O3S/c1-3-10-25-20(28)16-6-4-5-7-18(16)24-21(25)29-12-19(27)15-9-8-14(11-17(15)22)23-13(2)26/h3-9,11H,1,10,12H2,2H3,(H,23,26)