methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-4-methyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-4-methyl-pyrimidine-5-carboxylate Openeye Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-4-methyl-pyrimidine-5-carboxylate CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-4-methyl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylpyrimidine-5-carboxylate Traditional Name: 2-[4-(3-chlorophenyl)piperazino]-4-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN4O2/c1-12-15(16(23)24-2)11-19-17(20-12)22-8-6-21(7-9-22)14-5-3-4-13(18)10-14/h3-5,10-11H,6-9H2,1-2H3