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

Systemtic Name: 3-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)propyl-dimethyl-azanium Openeye Name: 3-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)propyl-dimethyl-ammonium CAS Name: 3-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)propyl-dimethylammonium IUPAC Name: 3-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)propyl-dimethylazanium Traditional Name: 3-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)propyl-dimethyl-ammonium Formula: C9H19N4S+ MolecularWeight: 215.33896

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1CCC[NH+](C)C

Isomeric SMILES

CCC1=NNC(=S)N1CCC[NH+](C)C

InChI

InChI=1S/C9H18N4S/c1-4-8-10-11-9(14)13(8)7-5-6-12(2)3/h4-7H2,1-3H3,(H,11,14)/p+1