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

Systemtic Name: 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2,2,2-tris(fluoranyl)ethyl]propanamide Openeye Name: 2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)propanamide CAS Name: 2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-N-(2,2,2-trifluoroethyl)propanamide IUPAC Name: 2-(3-methyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,2,2-trifluoroethyl)propanamide Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-(2,2,2-trifluoroethyl)propionamide Formula: C14H14F3N3O2S MolecularWeight: 345.34007

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC(F)(F)F)SC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CC(C(=O)NCC(F)(F)F)SC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C14H14F3N3O2S/c1-8(11(21)18-7-14(15,16)17)23-13-19-10-6-4-3-5-9(10)12(22)20(13)2/h3-6,8H,7H2,1-2H3,(H,18,21)