ethyl 2-[2,4-bis(oxidanylidene)-6-(phenylmethyl)-5-propan-2-yl-pyrimidin-1-yl]butanoate

Systemtic Name: ethyl 2-[2,4-bis(oxidanylidene)-6-(phenylmethyl)-5-propan-2-yl-pyrimidin-1-yl]butanoate Openeye Name: ethyl 2-(6-benzyl-5-isopropyl-2,4-dioxo-pyrimidin-1-yl)butanoate CAS Name: 2-[2,4-dioxo-6-(phenylmethyl)-5-propan-2-yl-1-pyrimidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-(6-benzyl-2,4-dioxo-5-propan-2-ylpyrimidin-1-yl)butanoate Traditional Name: 2-(6-benzyl-5-isopropyl-2,4-diketo-pyrimidin-1-yl)butyric acid ethyl ester Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C(=C(C(=O)NC1=O)C(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCC(C(=O)OCC)N1C(=C(C(=O)NC1=O)C(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C20H26N2O4/c1-5-15(19(24)26-6-2)22-16(12-14-10-8-7-9-11-14)17(13(3)4)18(23)21-20(22)25/h7-11,13,15H,5-6,12H2,1-4H3,(H,21,23,25)