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

Systemtic Name: ethyl 4-[4-[2-(4-chloranylphenoxy)ethanoyl]-3-methyl-piperazin-1-yl]carbonyl-2-methyl-6-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[2-(4-chlorophenoxy)acetyl]-3-methyl-piperazine-1-carbonyl]-2-methyl-6-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-[2-(4-chlorophenoxy)-1-oxoethyl]-3-methyl-1-piperazinyl]-oxomethyl]-2-methyl-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-(4-chlorophenoxy)acetyl]-3-methylpiperazine-1-carbonyl]-2-methyl-6-phenylpyrimidine-5-carboxylate Traditional Name: 4-[4-[2-(4-chlorophenoxy)acetyl]-3-methyl-piperazine-1-carbonyl]-2-methyl-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H29ClN4O5 MolecularWeight: 537.00666

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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)COC3=CC=C(C=C3)Cl)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C(=O)N2CCN(C(C2)C)C(=O)COC3=CC=C(C=C3)Cl)C)C4=CC=CC=C4

InChI

InChI=1S/C28H29ClN4O5/c1-4-37-28(36)24-25(20-8-6-5-7-9-20)30-19(3)31-26(24)27(35)32-14-15-33(18(2)16-32)23(34)17-38-22-12-10-21(29)11-13-22/h5-13,18H,4,14-17H2,1-3H3