methyl 4-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethylcarbamoyl]benzoate

Systemtic Name: methyl 4-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethylcarbamoyl]benzoate Openeye Name: methyl 4-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethylcarbamoyl]benzoate CAS Name: 4-[oxo-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethylcarbamoyl]benzoate Traditional Name: 4-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethylcarbamoyl]benzoic acid methyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCC2CCCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H24N2O5S2/c1-27-20(24)16-9-7-15(8-10-16)19(23)21-12-11-17-5-2-3-13-22(17)29(25,26)18-6-4-14-28-18/h4,6-10,14,17H,2-3,5,11-13H2,1H3,(H,21,23)