2-[3-(dimethylamino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-(dimethylamino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethyl-dimethyl-azanium Openeye Name: 2-[3-(dimethylamino)-5-thioxo-1H-1,2,4-triazol-4-yl]ethyl-dimethyl-ammonium CAS Name: 2-[3-(dimethylamino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethyl-dimethylammonium IUPAC Name: 2-[3-(dimethylamino)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethyl-dimethylazanium Traditional Name: 2-[3-(dimethylamino)-5-thioxo-1H-1,2,4-triazol-4-yl]ethyl-dimethyl-ammonium Formula: C8H18N5S+ MolecularWeight: 216.32702

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(=S)NN=C1N(C)C

Isomeric SMILES

C[NH+](C)CCN1C(=S)NN=C1N(C)C

InChI

InChI=1S/C8H17N5S/c1-11(2)5-6-13-7(12(3)4)9-10-8(13)14/h5-6H2,1-4H3,(H,10,14)/p+1