(phenylmethyl) (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-(phenylmethyl)-4,5-dihydro-2H-pyrimidine-3-carboxylate

Systemtic Name: (phenylmethyl) (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-(phenylmethyl)-4,5-dihydro-2H-pyrimidine-3-carboxylate Openeye Name: benzyl (2R,4S,5S)-5-benzyl-2-tert-butyl-6-methoxy-4-methyl-4,5-dihydro-2H-pyrimidine-3-carboxylate CAS Name: (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-(phenylmethyl)-4,5-dihydro-2H-pyrimidine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2R,4S,5S)-5-benzyl-2-tert-butyl-6-methoxy-4-methyl-4,5-dihydro-2H-pyrimidine-3-carboxylate Traditional Name: (2R,4S,5S)-5-benzyl-2-tert-butyl-6-methoxy-4-methyl-4,5-dihydro-2H-pyrimidine-3-carboxylic acid benzyl ester Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=NC(N1C(=O)OCC2=CC=CC=C2)C(C)(C)C)OC)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@@H](C(=N[C@H](N1C(=O)OCC2=CC=CC=C2)C(C)(C)C)OC)CC3=CC=CC=C3

InChI

InChI=1S/C25H32N2O3/c1-18-21(16-19-12-8-6-9-13-19)22(29-5)26-23(25(2,3)4)27(18)24(28)30-17-20-14-10-7-11-15-20/h6-15,18,21,23H,16-17H2,1-5H3/t18-,21-,23+/m0/s1