N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C22H14ClF3N4O2S MolecularWeight: 490.88537

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)C(F)(F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)C(F)(F)F)Cl

InChI

InChI=1S/C22H14ClF3N4O2S/c23-16-10-13(22(24,25)26)11-27-19(16)29-18(31)12-33-21-28-17-9-5-4-8-15(17)20(32)30(21)14-6-2-1-3-7-14/h1-11H,12H2,(H,27,29,31)