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

Systemtic Name: tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-prop-2-enylpyrimidin-4-yl)amino]propanoate Openeye Name: tert-butyl (2S)-2-[(5-allylpyrimidin-4-yl)amino]-3-[4-(dimethylcarbamoyloxy)phenyl]propanoate CAS Name: (2S)-3-[4-[dimethylamino(oxo)methoxy]phenyl]-2-[(5-prop-2-enyl-4-pyrimidinyl)amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-prop-2-enylpyrimidin-4-yl)amino]propanoate Traditional Name: (2S)-2-[(5-allylpyrimidin-4-yl)amino]-3-[4-(dimethylcarbamoyloxy)phenyl]propionic acid tert-butyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

Click to see the large picture

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=C2CC=C

Isomeric SMILES

CC(C)(C)OC(=O)[C@H](CC1=CC=C(C=C1)OC(=O)N(C)C)NC2=NC=NC=C2CC=C

InChI

InChI=1S/C23H30N4O4/c1-7-8-17-14-24-15-25-20(17)26-19(21(28)31-23(2,3)4)13-16-9-11-18(12-10-16)30-22(29)27(5)6/h7,9-12,14-15,19H,1,8,13H2,2-6H3,(H,24,25,26)/t19-/m0/s1