4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[(3S,5S)-3,5-dimethylpiperidino]-2-keto-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C15H19N4OS2- MolecularWeight: 335.46756

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C(=NN=C2[S-])C3=CC=CS3)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)CN2C(=NN=C2[S-])C3=CC=CS3)C

InChI

InChI=1S/C15H20N4OS2/c1-10-6-11(2)8-18(7-10)13(20)9-19-14(16-17-15(19)21)12-4-3-5-22-12/h3-5,10-11H,6-9H2,1-2H3,(H,17,21)/p-1/t10-,11-/m0/s1