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

Systemtic Name: propan-2-yl 2-[(5-phenethylpyrimidin-4-yl)amino]-3-phenyl-propanoate Openeye Name: isopropyl 2-[(5-phenethylpyrimidin-4-yl)amino]-3-phenyl-propanoate CAS Name: 2-[(5-phenethyl-4-pyrimidinyl)amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(5-phenethylpyrimidin-4-yl)amino]-3-phenylpropanoate Traditional Name: 2-[(5-phenethylpyrimidin-4-yl)amino]-3-phenyl-propionic acid isopropyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27N3O2/c1-18(2)29-24(28)22(15-20-11-7-4-8-12-20)27-23-21(16-25-17-26-23)14-13-19-9-5-3-6-10-19/h3-12,16-18,22H,13-15H2,1-2H3,(H,25,26,27)