methyl 4-[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[5-azanyl-6-[ethyl-(3-methylphenyl)amino]pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]oxybenzoate CAS Name: 4-[[5-amino-6-(N-ethyl-3-methylanilino)-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[5-amino-6-(N-ethyl-3-methylanilino)pyrimidin-4-yl]oxybenzoate Traditional Name: 4-[5-amino-6-(N-ethyl-3-methyl-anilino)pyrimidin-4-yl]oxybenzoic acid methyl ester Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)N

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)OC3=CC=C(C=C3)C(=O)OC)N

InChI

InChI=1S/C21H22N4O3/c1-4-25(16-7-5-6-14(2)12-16)19-18(22)20(24-13-23-19)28-17-10-8-15(9-11-17)21(26)27-3/h5-13H,4,22H2,1-3H3