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

Systemtic Name: 4-(2-methoxyethyl)-3-[(3S)-1-methylsulfonylpiperidin-3-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methoxyethyl)-3-[(3S)-1-methylsulfonyl-3-piperidyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methoxyethyl)-3-[(3S)-1-methylsulfonyl-3-piperidinyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methoxyethyl)-3-[(3S)-1-methylsulfonylpiperidin-3-yl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(3S)-1-mesyl-3-piperidyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Formula: C11H20N4O3S2 MolecularWeight: 320.4315

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NNC1=S)C2CCCN(C2)S(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C11H20N4O3S2/c1-18-7-6-15-10(12-13-11(15)19)9-4-3-5-14(8-9)20(2,16)17/h9H,3-8H2,1-2H3,(H,13,19)/t9-/m0/s1