2-[(4-azanyl-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)sulfanyl]ethanenitrile tetrafluoroborate

Systemtic Name: 2-[(4-azanyl-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)sulfanyl]ethanenitrile tetrafluoroborate Openeye Name: 2-[(4-amino-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)sulfanyl]acetonitrile tetrafluoroborate CAS Name: 2-[(4-amino-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)thio]acetonitrile tetrafluoroborate IUPAC Name: 2-[(4-amino-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)sulfanyl]acetonitrile tetrafluoroborate Traditional Name: 2-[(4-amino-1,5-dimethyl-1,2,4-triazol-4-ium-3-yl)thio]acetonitrile tetrafluoroborate Formula: C6H10BF4N5S MolecularWeight: 271.046713

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC1=[N+](C(=NN1C)SCC#N)N

Isomeric SMILES

[B-](F)(F)(F)F.CC1=[N+](C(=NN1C)SCC#N)N

InChI

InChI=1S/C6H10N5S.BF4/c1-5-10(2)9-6(11(5)8)12-4-3-7;2-1(3,4)5/h4,8H2,1-2H3;/q+1;-1