O3-tert-butyl O5-ethyl 2-azanyl-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylate

Systemtic Name: O3-tert-butyl O5-ethyl 2-azanyl-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylate Openeye Name: O3-tert-butyl O5-ethyl 2-amino-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylate CAS Name: 2-amino-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylic acid O3-tert-butyl ester O5-ethyl ester IUPAC Name: 3-O-tert-butyl 5-O-ethyl 2-amino-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylate Traditional Name: 2-amino-4-(3,3-dimethoxypropyl)-6-phenyl-4H-pyrimidine-3,5-dicarboxylic acid O3-tert-butyl ester O5-ethyl ester Formula: C23H33N3O6 MolecularWeight: 447.52462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N(C1CCC(OC)OC)C(=O)OC(C)(C)C)N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(N=C(N(C1CCC(OC)OC)C(=O)OC(C)(C)C)N)C2=CC=CC=C2

InChI

InChI=1S/C23H33N3O6/c1-7-31-20(27)18-16(13-14-17(29-5)30-6)26(22(28)32-23(2,3)4)21(24)25-19(18)15-11-9-8-10-12-15/h8-12,16-17H,7,13-14H2,1-6H3,(H2,24,25)