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

Systemtic Name: N-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C21H18ClF3N4O2S MolecularWeight: 482.90643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=N4)C(F)(F)F)Cl

InChI

InChI=1S/C21H18ClF3N4O2S/c22-15-9-12(21(23,24)25)10-26-18(15)28-17(30)11-32-20-27-16-8-4-3-7-14(16)19(31)29(20)13-5-1-2-6-13/h3-4,7-10,13H,1-2,5-6,11H2,(H,26,28,30)