ethyl 2-butyl-6-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-4-oxidanylidene-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-butyl-6-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-4-oxidanylidene-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-4-oxo-1H-pyrimidine-5-carboxylate CAS Name: 2-butyl-6-[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]-4-oxo-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-6-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-4-oxo-1H-pyrimidine-5-carboxylate Traditional Name: 6-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-4-keto-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)OCC

Isomeric SMILES

CCCCC1=NC(=O)C(=C(N1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)OCC

InChI

InChI=1S/C28H32N2O5/c1-6-8-13-22-29-24(23(25(31)30-22)27(33)34-7-2)19-16-14-18(15-17-19)20-11-9-10-12-21(20)26(32)35-28(3,4)5/h9-12,14-17H,6-8,13H2,1-5H3,(H,29,30,31)