ethyl 2,4-dimethyl-5-[3-[4-(phenylmethyl)piperazin-1-yl]propylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[3-[4-(phenylmethyl)piperazin-1-yl]propylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[3-(4-benzylpiperazin-1-yl)propylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[3-[4-(phenylmethyl)-1-piperazinyl]propylamino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(4-benzylpiperazin-1-yl)propylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[3-(4-benzylpiperazino)propylcarbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H34N4O3 MolecularWeight: 426.55176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCCCN2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C24H34N4O3/c1-4-31-24(30)21-18(2)22(26-19(21)3)23(29)25-11-8-12-27-13-15-28(16-14-27)17-20-9-6-5-7-10-20/h5-7,9-10,26H,4,8,11-17H2,1-3H3,(H,25,29)