ethyl 2-butyl-6-chloranyl-4-methyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-butyl-6-chloranyl-4-methyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 3-[[4-(2-tert-butoxycarbonylphenyl)phenyl]methyl]-2-butyl-6-chloro-4-methyl-4H-pyrimidine-5-carboxylate CAS Name: 2-butyl-6-chloro-4-methyl-3-[[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-6-chloro-4-methyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylate Traditional Name: 3-[4-(2-tert-butoxycarbonylphenyl)benzyl]-2-butyl-6-chloro-4-methyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C30H37ClN2O4 MolecularWeight: 525.07878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C(=O)OCC)Cl

Isomeric SMILES

CCCCC1=NC(=C(C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C)C(=O)OCC)Cl

InChI

InChI=1S/C30H37ClN2O4/c1-7-9-14-25-32-27(31)26(29(35)36-8-2)20(3)33(25)19-21-15-17-22(18-16-21)23-12-10-11-13-24(23)28(34)37-30(4,5)6/h10-13,15-18,20H,7-9,14,19H2,1-6H3