propan-2-yl 2,4-dimethyl-5-[2-(4-phenylpiperazin-1-yl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[2-(4-phenylpiperazin-1-yl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-[2-(4-phenylpiperazin-1-yl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[2-(4-phenyl-1-piperazinyl)ethylamino]methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-[2-(4-phenylpiperazin-1-yl)ethylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[2-(4-phenylpiperazino)ethylcarbamoyl]-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C23H32N4O3/c1-16(2)30-23(29)20-17(3)21(25-18(20)4)22(28)24-10-11-26-12-14-27(15-13-26)19-8-6-5-7-9-19/h5-9,16,25H,10-15H2,1-4H3,(H,24,28)