5-(2,2-dimethylpropylsulfanyl)-2-methyl-1H-1,2,4-triazol-2-ium

Systemtic Name: 5-(2,2-dimethylpropylsulfanyl)-2-methyl-1H-1,2,4-triazol-2-ium Openeye Name: 5-(2,2-dimethylpropylsulfanyl)-2-methyl-1H-1,2,4-triazol-2-ium CAS Name: 5-(2,2-dimethylpropylthio)-2-methyl-1H-1,2,4-triazol-2-ium IUPAC Name: 5-(2,2-dimethylpropylsulfanyl)-2-methyl-1H-1,2,4-triazol-2-ium Traditional Name: 2-methyl-5-(neopentylthio)-1H-1,2,4-triazol-2-ium Formula: C8H16N3S+ MolecularWeight: 186.29774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CSC1=NC=[N+](N1)C

Isomeric SMILES

CC(C)(C)CSC1=NC=[N+](N1)C

InChI

InChI=1S/C8H15N3S/c1-8(2,3)5-12-7-9-6-11(4)10-7/h6H,5H2,1-4H3/p+1