ethyl 2,4-dimethyl-5-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[4-(4-propylphenyl)sulfonylpiperazine-1-carbonyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C(=C(N3)C)C(=O)OCC)C

InChI

InChI=1S/C23H31N3O5S/c1-5-7-18-8-10-19(11-9-18)32(29,30)26-14-12-25(13-15-26)22(27)21-16(3)20(17(4)24-21)23(28)31-6-2/h8-11,24H,5-7,12-15H2,1-4H3