methyl 4-[[2,6-bis[(4-methoxycarbonylphenyl)amino]pyrimidin-4-yl]amino]benzoate

Systemtic Name: methyl 4-[[2,6-bis[(4-methoxycarbonylphenyl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: methyl 4-[[2,6-bis(4-methoxycarbonylanilino)pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[2,6-bis(4-methoxycarbonylanilino)-4-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2,6-bis(4-methoxycarbonylanilino)pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[2,6-bis(4-carbomethoxyanilino)pyrimidin-4-yl]amino]benzoic acid methyl ester Formula: C28H25N5O6 MolecularWeight: 527.528

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=CC(=NC(=N2)NC3=CC=C(C=C3)C(=O)OC)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=CC(=NC(=N2)NC3=CC=C(C=C3)C(=O)OC)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C28H25N5O6/c1-37-25(34)17-4-10-20(11-5-17)29-23-16-24(30-21-12-6-18(7-13-21)26(35)38-2)33-28(32-23)31-22-14-8-19(9-15-22)27(36)39-3/h4-16H,1-3H3,(H3,29,30,31,32,33)