1-(2-ethylpiperidin-1-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2-ethylpiperidin-1-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanyl-ethanone Openeye Name: 1-(2-ethyl-1-piperidyl)-2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-(2-ethyl-1-piperidinyl)-2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-(2-ethylpiperidin-1-yl)-2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylethanone Traditional Name: 1-(2-ethylpiperidino)-2-[(5-piperidinosulfonyl-2-pyridyl)thio]ethanone Formula: C19H29N3O3S2 MolecularWeight: 411.58186

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCC1CCCCN1C(=O)CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

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