4-methyl-3-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-methyl-3-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3S)-1-besyl-3-piperidyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NNC1=S)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H18N4O2S2/c1-17-13(15-16-14(17)21)11-6-5-9-18(10-11)22(19,20)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10H2,1H3,(H,16,21)/t11-/m0/s1