2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium

Systemtic Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium Openeye Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethylammonium CAS Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethylammonium IUPAC Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethylazanium Traditional Name: 2-[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]ethylammonium Formula: C6H13N4S+ MolecularWeight: 173.25922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC[NH3+]

Isomeric SMILES

CC1=NN=C(N1C)SCC[NH3+]

InChI

InChI=1S/C6H12N4S/c1-5-8-9-6(10(5)2)11-4-3-7/h3-4,7H2,1-2H3/p+1