[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] naphthalene-1-carboxylate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] naphthalene-1-carboxylate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C28H21N3O2 MolecularWeight: 431.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=CC=CC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O2/c1-19-29-26(21-9-3-2-4-10-21)18-27(30-19)31-22-14-16-23(17-15-22)33-28(32)25-13-7-11-20-8-5-6-12-24(20)25/h2-18H,1H3,(H,29,30,31)