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

Systemtic Name: ethyl 2-azanyl-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-amino-3-[[4-(2-tert-butoxycarbonylphenyl)phenyl]methyl]-4H-pyrimidine-5-carboxylate CAS Name: 2-amino-3-[[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-[[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]methyl]-4H-pyrimidine-5-carboxylate Traditional Name: 2-amino-3-[4-(2-tert-butoxycarbonylphenyl)benzyl]-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)N

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)N

InChI

InChI=1S/C25H29N3O4/c1-5-31-22(29)19-14-27-24(26)28(16-19)15-17-10-12-18(13-11-17)20-8-6-7-9-21(20)23(30)32-25(2,3)4/h6-14H,5,15-16H2,1-4H3,(H2,26,27)