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

Systemtic Name: ethyl 4-[[2-[(4-ethoxycarbonylphenyl)amino]-6-methyl-pyrimidin-4-yl]amino]benzoate Openeye Name: ethyl 4-[[2-(4-ethoxycarbonylanilino)-6-methyl-pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[2-(4-ethoxycarbonylanilino)-6-methyl-4-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-ethoxycarbonylanilino)-6-methylpyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[2-(4-carbethoxyanilino)-6-methyl-pyrimidin-4-yl]amino]benzoic acid ethyl ester Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C23H24N4O4/c1-4-30-21(28)16-6-10-18(11-7-16)25-20-14-15(3)24-23(27-20)26-19-12-8-17(9-13-19)22(29)31-5-2/h6-14H,4-5H2,1-3H3,(H2,24,25,26,27)