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

Systemtic Name: 3-[(3S)-1-methylsulfonylpiperidin-3-yl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(3S)-1-methylsulfonyl-3-piperidyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3S)-1-methylsulfonyl-3-piperidinyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3S)-1-methylsulfonylpiperidin-3-yl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[(3S)-1-mesyl-3-piperidyl]-1H-1,2,4-triazole-5-thione Formula: C11H18N4O2S2 MolecularWeight: 302.41622

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC(C1)C2=NNC(=S)N2CC=C

Isomeric SMILES

CS(=O)(=O)N1CCC[C@@H](C1)C2=NNC(=S)N2CC=C

InChI

InChI=1S/C11H18N4O2S2/c1-3-6-15-10(12-13-11(15)18)9-5-4-7-14(8-9)19(2,16)17/h3,9H,1,4-8H2,2H3,(H,13,18)/t9-/m0/s1