methyl 2,4-dimethyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[4-[(4-methyl-1-piperazinyl)methyl]anilino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[[4-[(4-methylpiperazino)methyl]phenyl]carbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C

InChI

InChI=1S/C21H28N4O3/c1-14-18(21(27)28-4)15(2)22-19(14)20(26)23-17-7-5-16(6-8-17)13-25-11-9-24(3)10-12-25/h5-8,22H,9-13H2,1-4H3,(H,23,26)