ethyl 2-methyl-4-[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-6-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methyl-4-[3-methyl-4-(2-methylpropanoyl)piperazin-1-yl]carbonyl-6-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methyl-4-[3-methyl-4-(2-methylpropanoyl)piperazine-1-carbonyl]-6-phenyl-pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[3-methyl-4-(2-methylpropanoyl)piperazine-1-carbonyl]-6-phenylpyrimidine-5-carboxylate Traditional Name: 4-(4-isobutyryl-3-methyl-piperazine-1-carbonyl)-2-methyl-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C(=O)N2CCN(C(C2)C)C(=O)C(C)C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C(=O)N2CCN(C(C2)C)C(=O)C(C)C)C)C3=CC=CC=C3

InChI

InChI=1S/C24H30N4O4/c1-6-32-24(31)19-20(18-10-8-7-9-11-18)25-17(5)26-21(19)23(30)27-12-13-28(16(4)14-27)22(29)15(2)3/h7-11,15-16H,6,12-14H2,1-5H3