ethyl 4-[[2-[(2-chloranylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(2-chloranylphenoxy)methyl]-6-methyl-pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 4-[[2-[(2-chlorophenoxy)methyl]-6-methyl-pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[2-[(2-chlorophenoxy)methyl]-6-methyl-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(2-chlorophenoxy)methyl]-6-methylpyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[2-[(2-chlorophenoxy)methyl]-6-methyl-pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)COC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)COC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClN3O3/c1-3-27-21(26)15-8-10-16(11-9-15)24-19-12-14(2)23-20(25-19)13-28-18-7-5-4-6-17(18)22/h4-12H,3,13H2,1-2H3,(H,23,24,25)