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

Systemtic Name: ethyl 4-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[[4-(2-thienylmethylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 4-[[4-[oxo-(thiophen-2-ylmethylamino)methyl]-1-piperidinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(thiophen-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(2-thenylcarbamoyl)piperidino]sulfonylbenzoic acid ethyl ester Formula: C20H24N2O5S2 MolecularWeight: 436.54496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H24N2O5S2/c1-2-27-20(24)16-5-7-18(8-6-16)29(25,26)22-11-9-15(10-12-22)19(23)21-14-17-4-3-13-28-17/h3-8,13,15H,2,9-12,14H2,1H3,(H,21,23)