methyl (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-(3-propan-2-yloxypropylamino)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-(3-propan-2-yloxypropylamino)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-benzyl-2-(3-isopropoxypropylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-4-phenyl-1-(phenylmethyl)-2-(3-propan-2-yloxypropylamino)-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-6-methyl-4-phenyl-2-(3-propan-2-yloxypropylamino)-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-benzyl-2-(3-isopropoxypropylamino)-6-methyl-4-phenyl-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C26H33N3O3 MolecularWeight: 435.55852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1CC2=CC=CC=C2)NCCCOC(C)C)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N=C(N1CC2=CC=CC=C2)NCCCOC(C)C)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C26H33N3O3/c1-19(2)32-17-11-16-27-26-28-24(22-14-9-6-10-15-22)23(25(30)31-4)20(3)29(26)18-21-12-7-5-8-13-21/h5-10,12-15,19,24H,11,16-18H2,1-4H3,(H,27,28)/t24-/m0/s1