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

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3,4-difluorophenyl)acetamide CAS Name: N-(3,4-difluorophenyl)-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3,4-difluorophenyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(3,4-difluorophenyl)acetamide Formula: C19H15F2N3O2S MolecularWeight: 387.403106

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)F)F

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC(=C(C=C3)F)F

InChI

InChI=1S/C19H15F2N3O2S/c1-2-9-24-18(26)13-5-3-4-6-16(13)23-19(24)27-11-17(25)22-12-7-8-14(20)15(21)10-12/h2-8,10H,1,9,11H2,(H,22,25)