pentyl 3-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]propanoate

Systemtic Name: pentyl 3-[6-methyl-4-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]propanoate Openeye Name: pentyl 3-(2-benzyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanoate CAS Name: 3-[6-methyl-4-oxo-2-(phenylmethyl)-1H-pyrimidin-5-yl]propanoic acid pentyl ester IUPAC Name: pentyl 3-(2-benzyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(2-benzyl-4-keto-6-methyl-1H-pyrimidin-5-yl)propionic acid amyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCC1=C(NC(=NC1=O)CC2=CC=CC=C2)C

Isomeric SMILES

CCCCCOC(=O)CCC1=C(NC(=NC1=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C20H26N2O3/c1-3-4-8-13-25-19(23)12-11-17-15(2)21-18(22-20(17)24)14-16-9-6-5-7-10-16/h5-7,9-10H,3-4,8,11-14H2,1-2H3,(H,21,22,24)