2-methoxy-4-[5-methyl-2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzoic acid

Systemtic Name: 2-methoxy-4-[5-methyl-2-[(4-morpholin-4-ylphenyl)amino]pyrimidin-4-yl]benzoic acid Openeye Name: 2-methoxy-4-[5-methyl-2-(4-morpholinoanilino)pyrimidin-4-yl]benzoic acid CAS Name: 2-methoxy-4-[5-methyl-2-[4-(4-morpholinyl)anilino]-4-pyrimidinyl]benzoic acid IUPAC Name: 2-methoxy-4-[5-methyl-2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]benzoic acid Traditional Name: 2-methoxy-4-[5-methyl-2-(4-morpholinoanilino)pyrimidin-4-yl]benzoic acid Formula: C23H24N4O4 MolecularWeight: 420.46106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC(=C(C=C2)C(=O)O)OC)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=CN=C(N=C1C2=CC(=C(C=C2)C(=O)O)OC)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H24N4O4/c1-15-14-24-23(25-17-4-6-18(7-5-17)27-9-11-31-12-10-27)26-21(15)16-3-8-19(22(28)29)20(13-16)30-2/h3-8,13-14H,9-12H2,1-2H3,(H,28,29)(H,24,25,26)