[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2-(3,5-dimethylphenoxy)ethanoate

Systemtic Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2-(3,5-dimethylphenoxy)ethanoate Openeye Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2-(3,5-dimethylphenoxy)acetate CAS Name: 2-(3,5-dimethylphenoxy)acetic acid [4-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2-(3,5-dimethylphenoxy)acetate Traditional Name: 2-(3,5-dimethylphenoxy)acetic acid [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)OC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)OC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H23N3O3/c1-18-12-19(2)14-23(13-18)31-16-26(30)32-22-10-8-21(9-11-22)29-25-15-24(27-17-28-25)20-6-4-3-5-7-20/h3-15,17H,16H2,1-2H3,(H,27,28,29)