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

Systemtic Name: methyl 2,4-dimethyl-5-[[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-[[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[2-methyl-4-(4-methyl-1-piperazinyl)anilino]-oxomethyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-[[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[[2-methyl-4-(4-methylpiperazino)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(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCN(CC2)C)NC(=O)C3=C(C(=C(N3)C)C(=O)OC)C

InChI

InChI=1S/C21H28N4O3/c1-13-12-16(25-10-8-24(4)9-11-25)6-7-17(13)23-20(26)19-14(2)18(15(3)22-19)21(27)28-5/h6-7,12,22H,8-11H2,1-5H3,(H,23,26)