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

Systemtic Name: 2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-(4-oxo-3-sec-butyl-quinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[(3-butan-2-yl-4-oxo-2-quinazolinyl)thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(3-butan-2-yl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[(4-keto-3-sec-butyl-quinazolin-2-yl)thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(F)(F)F

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC(F)(F)F

InChI

InChI=1S/C16H18F3N3O2S/c1-3-10(2)22-14(24)11-6-4-5-7-12(11)21-15(22)25-8-13(23)20-9-16(17,18)19/h4-7,10H,3,8-9H2,1-2H3,(H,20,23)