N-[2-(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]-2-oxidanylidene-cyclohexane-1-carboxamide

Systemtic Name: N-[2-(5-azanyl-3-methylsulfanyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]-2-oxidanylidene-cyclohexane-1-carboxamide Openeye Name: N-[2-(5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]-2-oxo-cyclohexanecarboxamide CAS Name: N-[2-[5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-5-(trifluoromethyl)phenyl]-2-oxo-1-cyclohexanecarboxamide IUPAC Name: N-[2-(5-amino-3-methylsulfanyl-1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]-2-oxocyclohexane-1-carboxamide Traditional Name: N-[2-[5-amino-3-(methylthio)-1,2,4-triazol-1-yl]-5-(trifluoromethyl)phenyl]-2-keto-cyclohexanecarboxamide Formula: C17H18F3N5O2S MolecularWeight: 413.41733

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=N1)N)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3CCCCC3=O

Isomeric SMILES

CSC1=NN(C(=N1)N)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3CCCCC3=O

InChI

InChI=1S/C17H18F3N5O2S/c1-28-16-23-15(21)25(24-16)12-7-6-9(17(18,19)20)8-11(12)22-14(27)10-4-2-3-5-13(10)26/h6-8,10H,2-5H2,1H3,(H,22,27)(H2,21,23,24)