2-methoxyethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2,6-dimethyl-pyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]carbonyl-2,6-dimethyl-pyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-2,6-dimethyl-5-pyrimidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,6-dimethylpyrimidine-5-carboxylate Traditional Name: 4-[4-(3-chlorophenyl)piperazine-1-carbonyl]-2,6-dimethyl-pyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C21H25ClN4O4 MolecularWeight: 432.9006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)OCCOC)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)OCCOC)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H25ClN4O4/c1-14-18(21(28)30-12-11-29-3)19(24-15(2)23-14)20(27)26-9-7-25(8-10-26)17-6-4-5-16(22)13-17/h4-6,13H,7-12H2,1-3H3