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

Systemtic Name: hexyl 2-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]hexanoate Openeye Name: hexyl 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 hexyl ester IUPAC Name: hexyl 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 hexyl ester Formula: C24H34N2O3 MolecularWeight: 398.53836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)CC2=CC=CC=C2)C

Isomeric SMILES

CCCCCCOC(=O)C(CCCC)C1=C(NC(=NC1=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C24H34N2O3/c1-4-6-8-12-16-29-24(28)20(15-7-5-2)22-18(3)25-21(26-23(22)27)17-19-13-10-9-11-14-19/h9-11,13-14,20H,4-8,12,15-17H2,1-3H3,(H,25,26,27)