methyl 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoate Openeye Name: methyl 2-[[5-(1-piperidylsulfonyl)-2-pyridyl]sulfanyl]propanoate CAS Name: 2-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-(5-piperidin-1-ylsulfonylpyridin-2-yl)sulfanylpropanoate Traditional Name: 2-[(5-piperidinosulfonyl-2-pyridyl)thio]propionic acid methyl ester Formula: C14H20N2O4S2 MolecularWeight: 344.4496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC(C(=O)OC)SC1=NC=C(C=C1)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C14H20N2O4S2/c1-11(14(17)20-2)21-13-7-6-12(10-15-13)22(18,19)16-8-4-3-5-9-16/h6-7,10-11H,3-5,8-9H2,1-2H3