N-(1-cyanocyclopentyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]acetamide Formula: C17H15F3N4OS MolecularWeight: 380.38741

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C17H15F3N4OS/c18-17(19,20)15-22-12-6-2-1-5-11(12)14(23-15)26-9-13(25)24-16(10-21)7-3-4-8-16/h1-2,5-6H,3-4,7-9H2,(H,24,25)