2-butyl-4-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-phenyl-4H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-butyl-4-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-phenyl-4H-pyrimidine-5-carboxylic acid Openeye Name: 3-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-4-methyl-6-phenyl-4H-pyrimidine-5-carboxylic acid CAS Name: 2-butyl-4-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]-6-phenyl-4H-pyrimidine-5-carboxylic acid IUPAC Name: 2-butyl-4-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-phenyl-4H-pyrimidine-5-carboxylic acid Traditional Name: 3-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-4-methyl-6-phenyl-4H-pyrimidine-5-carboxylic acid Formula: C33H36N2O4 MolecularWeight: 524.64994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(N1C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC(=C(C(N1C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C33H36N2O4/c1-6-7-17-28-34-30(24-13-9-8-10-14-24)29(31(36)37)22(2)35(28)25-20-18-23(19-21-25)26-15-11-12-16-27(26)32(38)39-33(3,4)5/h8-16,18-22H,6-7,17H2,1-5H3,(H,36,37)