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

Systemtic Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Openeye Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile CAS Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]propanenitrile IUPAC Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanenitrile Traditional Name: 2-[[4-methyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]propionitrile Formula: C7H7F3N4S MolecularWeight: 236.21749

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NN=C(N1C)C(F)(F)F

Isomeric SMILES

CC(C#N)SC1=NN=C(N1C)C(F)(F)F

InChI

InChI=1S/C7H7F3N4S/c1-4(3-11)15-6-13-12-5(14(6)2)7(8,9)10/h4H,1-2H3