ethyl 4-(4-butanoyl-3-methyl-piperazin-1-yl)carbonyl-2-methyl-6-propyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-butanoyl-3-methyl-piperazin-1-yl)carbonyl-2-methyl-6-propyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-butanoyl-3-methyl-piperazine-1-carbonyl)-2-methyl-6-propyl-pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-(1-oxobutyl)-1-piperazinyl]-oxomethyl]-6-propyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-butanoyl-3-methylpiperazine-1-carbonyl)-2-methyl-6-propylpyrimidine-5-carboxylate Traditional Name: 4-(4-butyryl-3-methyl-piperazine-1-carbonyl)-2-methyl-6-propyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)CCC)C

Isomeric SMILES

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)CCC)C

InChI

InChI=1S/C21H32N4O4/c1-6-9-16-18(21(28)29-8-3)19(23-15(5)22-16)20(27)24-11-12-25(14(4)13-24)17(26)10-7-2/h14H,6-13H2,1-5H3