[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3,6-bis(chloranyl)-2-methoxy-benzoate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3,6-dichloro-2-methoxy-benzoate CAS Name: 3,6-dichloro-2-methoxybenzoic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 3,6-dichloro-2-methoxybenzoate Traditional Name: 3,6-dichloro-2-methoxy-benzoic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C25H19Cl2N3O3 MolecularWeight: 480.34266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3OC)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=C(C=CC(=C3OC)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H19Cl2N3O3/c1-15-28-21(16-6-4-3-5-7-16)14-22(29-15)30-17-8-10-18(11-9-17)33-25(31)23-19(26)12-13-20(27)24(23)32-2/h3-14H,1-2H3,(H,28,29,30)