methyl 2-methyl-4-[3-methyl-4-(4-pentylphenyl)carbonyl-piperazin-1-yl]carbonyl-6-propan-2-yl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2-methyl-4-[3-methyl-4-(4-pentylphenyl)carbonyl-piperazin-1-yl]carbonyl-6-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 4-isopropyl-2-methyl-6-[3-methyl-4-(4-pentylbenzoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2-methyl-4-[[3-methyl-4-[oxo-(4-pentylphenyl)methyl]-1-piperazinyl]-oxomethyl]-6-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-4-[3-methyl-4-(4-pentylbenzoyl)piperazine-1-carbonyl]-6-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 4-[4-(4-amylbenzoyl)-3-methyl-piperazine-1-carbonyl]-6-isopropyl-2-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2C)C(=O)C3=C(C(=NC(=N3)C)C(C)C)C(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2C)C(=O)C3=C(C(=NC(=N3)C)C(C)C)C(=O)OC

InChI

InChI=1S/C28H38N4O4/c1-7-8-9-10-21-11-13-22(14-12-21)26(33)32-16-15-31(17-19(32)4)27(34)25-23(28(35)36-6)24(18(2)3)29-20(5)30-25/h11-14,18-19H,7-10,15-17H2,1-6H3