ethyl 4-[4-(4-ethylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[4-(4-ethylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[4-(4-ethylpiperazine-1-carbonyl)-1-piperidyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[[4-[(4-ethyl-1-piperazinyl)-oxomethyl]-1-piperidinyl]sulfonyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-ethylpiperazine-1-carbonyl)piperidin-1-yl]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[4-(4-ethylpiperazine-1-carbonyl)piperidino]sulfonyl-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H34N4O5S MolecularWeight: 454.58346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(NC(=C3C(=O)OCC)C)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(NC(=C3C(=O)OCC)C)C

InChI

InChI=1S/C21H34N4O5S/c1-5-23-11-13-24(14-12-23)20(26)17-7-9-25(10-8-17)31(28,29)19-16(4)22-15(3)18(19)21(27)30-6-2/h17,22H,5-14H2,1-4H3