3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propylazanium

Systemtic Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propylazanium Openeye Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propylammonium CAS Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propylammonium IUPAC Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propylazanium Traditional Name: 3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propylammonium Formula: C6H13N4S+ MolecularWeight: 173.25922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCCC[NH3+]

Isomeric SMILES

CC1=NC(=NN1)SCCC[NH3+]

InChI

InChI=1S/C6H12N4S/c1-5-8-6(10-9-5)11-4-2-3-7/h2-4,7H2,1H3,(H,8,9,10)/p+1