methyl 2-(4-methoxyphenyl)-3-[2-[(6-methoxypyridin-3-yl)amino]-4-phenylazanyl-pyrimidin-5-yl]propanoate

Systemtic Name: methyl 2-(4-methoxyphenyl)-3-[2-[(6-methoxypyridin-3-yl)amino]-4-phenylazanyl-pyrimidin-5-yl]propanoate Openeye Name: methyl 3-[4-anilino-2-[(6-methoxy-3-pyridyl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propanoate CAS Name: 3-[4-anilino-2-[(6-methoxy-3-pyridinyl)amino]-5-pyrimidinyl]-2-(4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[4-anilino-2-[(6-methoxypyridin-3-yl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propanoate Traditional Name: 3-[4-anilino-2-[(6-methoxy-3-pyridyl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propionic acid methyl ester Formula: C27H27N5O4 MolecularWeight: 485.53438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC2=CN=C(N=C2NC3=CC=CC=C3)NC4=CN=C(C=C4)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(CC2=CN=C(N=C2NC3=CC=CC=C3)NC4=CN=C(C=C4)OC)C(=O)OC

InChI

InChI=1S/C27H27N5O4/c1-34-22-12-9-18(10-13-22)23(26(33)36-3)15-19-16-29-27(31-21-11-14-24(35-2)28-17-21)32-25(19)30-20-7-5-4-6-8-20/h4-14,16-17,23H,15H2,1-3H3,(H2,29,30,31,32)