methyl 4-[5-azanyl-6-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[5-azanyl-6-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[5-amino-6-(3,5-dimethylanilino)-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)N)C

InChI

InChI=1S/C20H20N4O3/c1-12-8-13(2)10-15(9-12)24-18-17(21)19(23-11-22-18)27-16-6-4-14(5-7-16)20(25)26-3/h4-11H,21H2,1-3H3,(H,22,23,24)