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

Systemtic Name: ethyl 4-[3-[(3-ethanoylphenyl)carbamoyl]piperidin-1-yl]sulfonyl-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[3-[(3-acetylphenyl)carbamoyl]-1-piperidyl]sulfonyl]-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-[[3-[(3-acetylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]-1-ethyl-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-acetylphenyl)carbamoyl]piperidin-1-yl]sulfonyl-1-ethyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 4-[3-[(3-acetylphenyl)carbamoyl]piperidino]sulfonyl-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)C)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3)C(=O)C)C(=O)OCC)C

InChI

InChI=1S/C25H33N3O6S/c1-6-28-16(3)22(25(31)34-7-2)23(17(28)4)35(32,33)27-13-9-11-20(15-27)24(30)26-21-12-8-10-19(14-21)18(5)29/h8,10,12,14,20H,6-7,9,11,13,15H2,1-5H3,(H,26,30)