2-methylpropyl 2-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]hexanoate

Systemtic Name: 2-methylpropyl 2-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]hexanoate Openeye Name: isobutyl 2-(2-benzyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)hexanoate CAS Name: 2-[6-methyl-4-oxo-2-(phenylmethyl)-1H-pyrimidin-5-yl]hexanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(2-benzyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)hexanoate Traditional Name: 2-(2-benzyl-4-keto-6-methyl-1H-pyrimidin-5-yl)hexanoic acid isobutyl ester Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=C(NC(=NC1=O)CC2=CC=CC=C2)C)C(=O)OCC(C)C

Isomeric SMILES

CCCCC(C1=C(NC(=NC1=O)CC2=CC=CC=C2)C)C(=O)OCC(C)C

InChI

InChI=1S/C22H30N2O3/c1-5-6-12-18(22(26)27-14-15(2)3)20-16(4)23-19(24-21(20)25)13-17-10-8-7-9-11-17/h7-11,15,18H,5-6,12-14H2,1-4H3,(H,23,24,25)