methyl 2-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[1-(2-thienylsulfonyl)-2-piperidyl]acetyl]amino]benzoate CAS Name: 2-[[1-oxo-2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-[1-(2-thienylsulfonyl)-2-piperidyl]acetyl]amino]benzoic acid methyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CC2CCCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CC2CCCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H22N2O5S2/c1-26-19(23)15-8-2-3-9-16(15)20-17(22)13-14-7-4-5-11-21(14)28(24,25)18-10-6-12-27-18/h2-3,6,8-10,12,14H,4-5,7,11,13H2,1H3,(H,20,22)