[4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate

Systemtic Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate Openeye Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [4-[(6-methyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-methylpyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [4-[(6-methylpyrimidin-4-yl)amino]phenyl] ester Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NC=N1)NC2=CC=C(C=C2)OC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O2/c1-15-13-19(22-14-21-15)23-17-8-10-18(11-9-17)25-20(24)12-7-16-5-3-2-4-6-16/h2-6,8-11,13-14H,7,12H2,1H3,(H,21,22,23)