ethyl 2-chloranyl-4-(4-methanoylpiperazin-1-yl)-6-methyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-chloranyl-4-(4-methanoylpiperazin-1-yl)-6-methyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-chloro-4-(4-formylpiperazin-1-yl)-6-methyl-pyrimidine-5-carboxylate CAS Name: 2-chloro-4-(4-formyl-1-piperazinyl)-6-methyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-(4-formylpiperazin-1-yl)-6-methylpyrimidine-5-carboxylate Traditional Name: 2-chloro-4-(4-formylpiperazino)-6-methyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C13H17ClN4O3 MolecularWeight: 312.75208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1N2CCN(CC2)C=O)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1N2CCN(CC2)C=O)Cl)C

InChI

InChI=1S/C13H17ClN4O3/c1-3-21-12(20)10-9(2)15-13(14)16-11(10)18-6-4-17(8-19)5-7-18/h8H,3-7H2,1-2H3