3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine-2-carbonitrile

Systemtic Name: 3-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine-2-carbonitrile Openeye Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine-2-carbonitrile CAS Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-5-(trifluoromethyl)-2-pyridinecarbonitrile IUPAC Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine-2-carbonitrile Traditional Name: 3-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-5-(trifluoromethyl)picolinonitrile Formula: C9H5F3N6S MolecularWeight: 286.23641

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NC(=C1SC2=NNC(=N2)N)C#N)C(F)(F)F

Isomeric SMILES

C1=C(C=NC(=C1SC2=NNC(=N2)N)C#N)C(F)(F)F

InChI

InChI=1S/C9H5F3N6S/c10-9(11,12)4-1-6(5(2-13)15-3-4)19-8-16-7(14)17-18-8/h1,3H,(H3,14,16,17,18)