N-[2-ethylsulfanyl-4-oxidanylidene-7-(trifluoromethyl)quinazolin-3-yl]-2-phenyl-ethanamide

Systemtic Name: N-[2-ethylsulfanyl-4-oxidanylidene-7-(trifluoromethyl)quinazolin-3-yl]-2-phenyl-ethanamide Openeye Name: N-[2-ethylsulfanyl-4-oxo-7-(trifluoromethyl)quinazolin-3-yl]-2-phenyl-acetamide CAS Name: N-[2-(ethylthio)-4-oxo-7-(trifluoromethyl)-3-quinazolinyl]-2-phenylacetamide IUPAC Name: N-[2-ethylsulfanyl-4-oxo-7-(trifluoromethyl)quinazolin-3-yl]-2-phenylacetamide Traditional Name: N-[2-(ethylthio)-4-keto-7-(trifluoromethyl)quinazolin-3-yl]-2-phenyl-acetamide Formula: C19H16F3N3O2S MolecularWeight: 407.40945

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=O)N1NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCSC1=NC2=C(C=CC(=C2)C(F)(F)F)C(=O)N1NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C19H16F3N3O2S/c1-2-28-18-23-15-11-13(19(20,21)22)8-9-14(15)17(27)25(18)24-16(26)10-12-6-4-3-5-7-12/h3-9,11H,2,10H2,1H3,(H,24,26)