1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-[(2R,6R)-2,6-dimethylpiperidino]-2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethanone Formula: C19H29N3O3S2 MolecularWeight: 411.58186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C19H29N3O3S2/c1-15-7-6-8-16(2)22(15)19(23)14-26-18-10-9-17(13-20-18)27(24,25)21-11-4-3-5-12-21/h9-10,13,15-16H,3-8,11-12,14H2,1-2H3/t15-,16-/m1/s1