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

Systemtic Name: methyl 4-[5-azanyl-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[5-amino-6-(3,5-dimethylphenoxy)-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[5-amino-6-(3,5-dimethylphenoxy)pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)OC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=NC=NC(=C2N)OC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C20H19N3O4/c1-12-8-13(2)10-16(9-12)27-19-17(21)18(22-11-23-19)26-15-6-4-14(5-7-15)20(24)25-3/h4-11H,21H2,1-3H3