ethyl 2,4-dimethyl-5-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[2-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[2-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-1-oxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[2-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]acetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H33N5O3 MolecularWeight: 427.53982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CN2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C)C

InChI

InChI=1S/C23H33N5O3/c1-7-31-23(30)20-16(5)21(25-17(20)6)18(29)13-27-8-10-28(11-9-27)19-12-15(4)24-22(26-19)14(2)3/h12,14,25H,7-11,13H2,1-6H3