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

Systemtic Name: ethyl 2-methyl-4-[3-methyl-4-(3-phenylpropanoyl)piperazin-1-yl]carbonyl-6-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methyl-4-[3-methyl-4-(3-phenylpropanoyl)piperazine-1-carbonyl]-6-phenyl-pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-(1-oxo-3-phenylpropyl)-1-piperazinyl]-oxomethyl]-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[3-methyl-4-(3-phenylpropanoyl)piperazine-1-carbonyl]-6-phenylpyrimidine-5-carboxylate Traditional Name: 4-(4-hydrocinnamoyl-3-methyl-piperazine-1-carbonyl)-2-methyl-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C29H32N4O4 MolecularWeight: 500.58878

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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)CCC3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C(=O)N2CCN(C(C2)C)C(=O)CCC3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C29H32N4O4/c1-4-37-29(36)25-26(23-13-9-6-10-14-23)30-21(3)31-27(25)28(35)32-17-18-33(20(2)19-32)24(34)16-15-22-11-7-5-8-12-22/h5-14,20H,4,15-19H2,1-3H3