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

Systemtic Name: 3-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-4-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-4-propyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-4-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-4-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3S)-1-besyl-3-piperidyl]-4-propyl-1H-1,2,4-triazole-5-thione Formula: C16H22N4O2S2 MolecularWeight: 366.50148

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NNC1=S)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCN1C(=NNC1=S)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H22N4O2S2/c1-2-10-20-15(17-18-16(20)23)13-7-6-11-19(12-13)24(21,22)14-8-4-3-5-9-14/h3-5,8-9,13H,2,6-7,10-12H2,1H3,(H,18,23)/t13-/m0/s1