3-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1H-1,2,4-triazole-5-thione Formula: C12H23N4S+ MolecularWeight: 255.40282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCN2C(=NNC2=S)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCN2C(=NNC2=S)C

InChI

InChI=1S/C12H22N4S/c1-10-6-3-4-7-15(10)8-5-9-16-11(2)13-14-12(16)17/h10H,3-9H2,1-2H3,(H,14,17)/p+1/t10-/m0/s1