[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate

Systemtic Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate Openeye Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)CCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)CCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2/c1-19-27-24(21-11-6-3-7-12-21)18-25(28-19)29-22-13-8-14-23(17-22)31-26(30)16-15-20-9-4-2-5-10-20/h2-14,17-18H,15-16H2,1H3,(H,27,28,29)