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

Systemtic Name: pentyl 2-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]hexanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C23H32N2O3 MolecularWeight: 384.51178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O3/c1-4-6-11-15-28-23(27)19(14-7-5-2)21-17(3)24-20(25-22(21)26)16-18-12-9-8-10-13-18/h8-10,12-13,19H,4-7,11,14-16H2,1-3H3,(H,24,25,26)