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

Systemtic Name: ethyl 2,4-dimethyl-5-[[2-methyl-4-(4-methylpiperazin-1-yl)phenyl]carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=C(C=C(C=C2)N3CCN(CC3)C)C)C

InChI

InChI=1S/C22H30N4O3/c1-6-29-22(28)19-15(3)20(23-16(19)4)21(27)24-18-8-7-17(13-14(18)2)26-11-9-25(5)10-12-26/h7-8,13,23H,6,9-12H2,1-5H3,(H,24,27)