4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-ium

Systemtic Name: 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-ium Openeye Name: 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-ium CAS Name: 4-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidin-1-ium IUPAC Name: 4-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)piperidin-1-ium Traditional Name: 4-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]piperidin-1-ium Formula: C9H17N4S+ MolecularWeight: 213.32308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2CC[NH2+]CC2

Isomeric SMILES

CN1C(=NN=C1SC)C2CC[NH2+]CC2

InChI

InChI=1S/C9H16N4S/c1-13-8(11-12-9(13)14-2)7-3-5-10-6-4-7/h7,10H,3-6H2,1-2H3/p+1