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

Systemtic Name: 2-(4-methoxyphenyl)-3-[2-[(6-methoxypyridin-3-yl)amino]-4-phenylazanyl-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[4-anilino-2-[(6-methoxy-3-pyridyl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propanoic acid CAS Name: 3-[4-anilino-2-[(6-methoxy-3-pyridinyl)amino]-5-pyrimidinyl]-2-(4-methoxyphenyl)propanoic acid IUPAC Name: 3-[4-anilino-2-[(6-methoxypyridin-3-yl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propanoic acid Traditional Name: 3-[4-anilino-2-[(6-methoxy-3-pyridyl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propionic acid Formula: C26H25N5O4 MolecularWeight: 471.5078

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C26H25N5O4/c1-34-21-11-8-17(9-12-21)22(25(32)33)14-18-15-28-26(30-20-10-13-23(35-2)27-16-20)31-24(18)29-19-6-4-3-5-7-19/h3-13,15-16,22H,14H2,1-2H3,(H,32,33)(H2,28,29,30,31)