N-[2-nitro-4-(trifluoromethyl)phenyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-nitro-4-(trifluoromethyl)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-[2-nitro-4-(trifluoromethyl)phenyl]acetamide CAS Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Formula: C20H15F3N4O4S MolecularWeight: 464.41771

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H15F3N4O4S/c1-2-9-26-18(29)13-5-3-4-6-14(13)25-19(26)32-11-17(28)24-15-8-7-12(20(21,22)23)10-16(15)27(30)31/h2-8,10H,1,9,11H2,(H,24,28)