methyl 2,4-dimethyl-5-[2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-[2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[1-oxo-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(4-p-cumenylsulfonylpiperazino)acetyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C23H31N3O5S/c1-15(2)18-6-8-19(9-7-18)32(29,30)26-12-10-25(11-13-26)14-20(27)22-16(3)21(17(4)24-22)23(28)31-5/h6-9,15,24H,10-14H2,1-5H3