methyl 2-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(2-thienylmethylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-(thiophen-2-ylmethylamino)methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(2-thenylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CS3

InChI

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