2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C17H18F3N3O2S MolecularWeight: 385.40393

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC(F)(F)F

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC(F)(F)F

InChI

InChI=1S/C17H18F3N3O2S/c18-17(19,20)10-21-14(24)9-26-16-22-13-8-4-3-7-12(13)15(25)23(16)11-5-1-2-6-11/h3-4,7-8,11H,1-2,5-6,9-10H2,(H,21,24)