2-[4-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-oxo-3-(2-thienylmethyl)quinazolin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[[4-oxo-3-(thiophen-2-ylmethyl)-2-quinazolinyl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-oxo-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[[4-keto-3-(2-thenyl)quinazolin-2-yl]thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C22H16F3N3O2S2 MolecularWeight: 475.50655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F)CC4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F)CC4=CC=CS4

InChI

InChI=1S/C22H16F3N3O2S2/c23-22(24,25)14-5-3-6-15(11-14)26-19(29)13-32-21-27-18-9-2-1-8-17(18)20(30)28(21)12-16-7-4-10-31-16/h1-11H,12-13H2,(H,26,29)