(phenylmethyl) 2,4-dimethyl-6-[3-methyl-4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 2,4-dimethyl-6-[3-methyl-4-(3,5,5-trimethylhexanoyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: benzyl 2,4-dimethyl-6-[3-methyl-4-(3,5,5-trimethylhexanoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-(3,5,5-trimethyl-1-oxohexyl)-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,4-dimethyl-6-[3-methyl-4-(3,5,5-trimethylhexanoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-[3-methyl-4-(3,5,5-trimethylhexanoyl)piperazine-1-carbonyl]pyrimidine-5-carboxylic acid benzyl ester Formula: C29H40N4O4 MolecularWeight: 508.6523

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C(=O)C2=C(C(=NC(=N2)C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1CN(CCN1C(=O)CC(C)CC(C)(C)C)C(=O)C2=C(C(=NC(=N2)C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H40N4O4/c1-19(16-29(5,6)7)15-24(34)33-14-13-32(17-20(33)2)27(35)26-25(21(3)30-22(4)31-26)28(36)37-18-23-11-9-8-10-12-23/h8-12,19-20H,13-18H2,1-7H3