ethyl 4-[3-[furan-2-ylmethyl(methyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[3-[furan-2-ylmethyl(methyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[3-[2-furylmethyl(methyl)carbamoyl]-1-piperidyl]sulfonyl]-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-[[3-[[2-furanylmethyl(methyl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]-1,2,5-trimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[furan-2-ylmethyl(methyl)carbamoyl]piperidin-1-yl]sulfonyl-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-[3-[2-furfuryl(methyl)carbamoyl]piperidino]sulfonyl-1,2,5-trimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H31N3O6S MolecularWeight: 465.56304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=CC=CO3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=CC=CO3)C)C)C

InChI

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