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

Systemtic Name: ethyl 4-[3-[(2,3-dimethylphenyl)carbamoyl]piperidin-1-yl]sulfonyl-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[3-[(2,3-dimethylphenyl)carbamoyl]-1-piperidyl]sulfonyl]-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 4-[[3-[(2,3-dimethylanilino)-oxomethyl]-1-piperidinyl]sulfonyl]-1-ethyl-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(2,3-dimethylphenyl)carbamoyl]piperidin-1-yl]sulfonyl-1-ethyl-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 4-[3-[(2,3-dimethylphenyl)carbamoyl]piperidino]sulfonyl-1-ethyl-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C25H35N3O5S MolecularWeight: 489.6275

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3C)C)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(=C1C)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC(=C3C)C)C(=O)OCC)C

InChI

InChI=1S/C25H35N3O5S/c1-7-28-18(5)22(25(30)33-8-2)23(19(28)6)34(31,32)27-14-10-12-20(15-27)24(29)26-21-13-9-11-16(3)17(21)4/h9,11,13,20H,7-8,10,12,14-15H2,1-6H3,(H,26,29)