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

Systemtic Name: 4-(2-methoxyethyl)-3-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3S)-1-(benzenesulfonyl)piperidin-3-yl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3S)-1-besyl-3-piperidyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NNC1=S)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COCCN1C(=NNC1=S)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H22N4O3S2/c1-23-11-10-20-15(17-18-16(20)24)13-6-5-9-19(12-13)25(21,22)14-7-3-2-4-8-14/h2-4,7-8,13H,5-6,9-12H2,1H3,(H,18,24)/t13-/m0/s1