4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile

Systemtic Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Openeye Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile CAS Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]butanenitrile IUPAC Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile Traditional Name: 4-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]butyronitrile Formula: C8H9F3N4S MolecularWeight: 250.24407

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCC#N)C(F)(F)F

Isomeric SMILES

CN1C(=NN=C1SCCCC#N)C(F)(F)F

InChI

InChI=1S/C8H9F3N4S/c1-15-6(8(9,10)11)13-14-7(15)16-5-3-2-4-12/h2-3,5H2,1H3