2-[4-azanyl-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[4-amino-5-thioxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[4-amino-5-sulfanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[4-amino-5-thioxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-N-(2-methoxyphenyl)acetamide Formula: C12H12F3N5O2S MolecularWeight: 347.31619

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CN2C(=S)N(C(=N2)C(F)(F)F)N

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CN2C(=S)N(C(=N2)C(F)(F)F)N

InChI

InChI=1S/C12H12F3N5O2S/c1-22-8-5-3-2-4-7(8)17-9(21)6-19-11(23)20(16)10(18-19)12(13,14)15/h2-5H,6,16H2,1H3,(H,17,21)