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

Systemtic Name: ethyl 4-[4-[2-(4-fluorophenyl)ethanoyl]-3-methyl-piperazin-1-yl]carbonyl-2-phenyl-6-propyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[2-(4-fluorophenyl)acetyl]-3-methyl-piperazine-1-carbonyl]-2-phenyl-6-propyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-[2-(4-fluorophenyl)-1-oxoethyl]-3-methyl-1-piperazinyl]-oxomethyl]-2-phenyl-6-propyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(4-fluorophenyl)acetyl]-3-methylpiperazine-1-carbonyl]-2-phenyl-6-propylpyrimidine-5-carboxylate Traditional Name: 4-[4-[2-(4-fluorophenyl)acetyl]-3-methyl-piperazine-1-carbonyl]-2-phenyl-6-propyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C30H33FN4O4 MolecularWeight: 532.605823

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)CC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)CC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C30H33FN4O4/c1-4-9-24-26(30(38)39-5-2)27(33-28(32-24)22-10-7-6-8-11-22)29(37)34-16-17-35(20(3)19-34)25(36)18-21-12-14-23(31)15-13-21/h6-8,10-15,20H,4-5,9,16-19H2,1-3H3