2-[1-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]piperidin-4-yl]ethanoate

Systemtic Name: 2-[1-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]piperidin-4-yl]ethanoate Openeye Name: 2-[1-[2-(1-methylimidazol-2-yl)sulfanylacetyl]-4-piperidyl]acetate CAS Name: 2-[1-[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]-4-piperidinyl]acetate IUPAC Name: 2-[1-[2-(1-methylimidazol-2-yl)sulfanylacetyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[2-[(1-methylimidazol-2-yl)thio]acetyl]-4-piperidyl]acetate Formula: C13H18N3O3S- MolecularWeight: 296.36532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCC(CC2)CC(=O)[O-]

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCC(CC2)CC(=O)[O-]

InChI

InChI=1S/C13H19N3O3S/c1-15-7-4-14-13(15)20-9-11(17)16-5-2-10(3-6-16)8-12(18)19/h4,7,10H,2-3,5-6,8-9H2,1H3,(H,18,19)/p-1