ethyl 1-ethyl-4-[3-(furan-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-ethyl-4-[3-(furan-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-ethyl-4-[[3-(2-furylmethylcarbamoyl)-1-piperidyl]sulfonyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-ethyl-4-[[3-[(2-furanylmethylamino)-oxomethyl]-1-piperidinyl]sulfonyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-[3-(furan-2-ylmethylcarbamoyl)piperidin-1-yl]sulfonyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-ethyl-4-[3-(2-furfurylcarbamoyl)piperidino]sulfonyl-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CO3)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CO3)C(=O)OCC)C

InChI

InChI=1S/C22H31N3O6S/c1-5-25-15(3)19(22(27)30-6-2)20(16(25)4)32(28,29)24-11-7-9-17(14-24)21(26)23-13-18-10-8-12-31-18/h8,10,12,17H,5-7,9,11,13-14H2,1-4H3,(H,23,26)