tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenylpyrimidin-4-yl)amino]propanoate

Systemtic Name: tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenylpyrimidin-4-yl)amino]propanoate Openeye Name: tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenylpyrimidin-4-yl)amino]propanoate CAS Name: (2S)-3-[4-[dimethylamino(oxo)methoxy]phenyl]-2-[(5-phenyl-4-pyrimidinyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenylpyrimidin-4-yl)amino]propanoate Traditional Name: (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenylpyrimidin-4-yl)amino]propionic acid tert-butyl ester Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC2=NC=NC=C2C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=C(C=C1)OC(=O)N(C)C)NC2=NC=NC=C2C3=CC=CC=C3

InChI

InChI=1S/C26H30N4O4/c1-26(2,3)34-24(31)22(15-18-11-13-20(14-12-18)33-25(32)30(4)5)29-23-21(16-27-17-28-23)19-9-7-6-8-10-19/h6-14,16-17,22H,15H2,1-5H3,(H,27,28,29)/t22-/m0/s1