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

Systemtic Name: ethyl 2-methyl-4-[3-methyl-4-[(3-methylphenyl)carbamoyl]piperazin-1-yl]carbonyl-6-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methyl-4-[3-methyl-4-(m-tolylcarbamoyl)piperazine-1-carbonyl]-6-phenyl-pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-[(3-methylanilino)-oxomethyl]-1-piperazinyl]-oxomethyl]-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[3-methyl-4-[(3-methylphenyl)carbamoyl]piperazine-1-carbonyl]-6-phenylpyrimidine-5-carboxylate Traditional Name: 2-methyl-4-[3-methyl-4-(m-tolylcarbamoyl)piperazine-1-carbonyl]-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H31N5O4 MolecularWeight: 501.57684

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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)NC3=CC=CC(=C3)C)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C(=O)N2CCN(C(C2)C)C(=O)NC3=CC=CC(=C3)C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H31N5O4/c1-5-37-27(35)23-24(21-11-7-6-8-12-21)29-20(4)30-25(23)26(34)32-14-15-33(19(3)17-32)28(36)31-22-13-9-10-18(2)16-22/h6-13,16,19H,5,14-15,17H2,1-4H3,(H,31,36)