propan-2-yl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenethylpyrimidin-4-yl)amino]propanoate

Systemtic Name: propan-2-yl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenethylpyrimidin-4-yl)amino]propanoate Openeye Name: isopropyl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenethylpyrimidin-4-yl)amino]propanoate CAS Name: 3-[4-[dimethylamino(oxo)methoxy]phenyl]-2-[(5-phenethyl-4-pyrimidinyl)amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenethylpyrimidin-4-yl)amino]propanoate Traditional Name: 3-[4-(dimethylcarbamoyloxy)phenyl]-2-[(5-phenethylpyrimidin-4-yl)amino]propionic acid isopropyl ester Formula: C27H32N4O4 MolecularWeight: 476.56738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC2=NC=NC=C2CCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C(CC1=CC=C(C=C1)OC(=O)N(C)C)NC2=NC=NC=C2CCC3=CC=CC=C3

InChI

InChI=1S/C27H32N4O4/c1-19(2)34-26(32)24(16-21-11-14-23(15-12-21)35-27(33)31(3)4)30-25-22(17-28-18-29-25)13-10-20-8-6-5-7-9-20/h5-9,11-12,14-15,17-19,24H,10,13,16H2,1-4H3,(H,28,29,30)