methyl 4-(2-morpholin-4-yl-7-pyridin-3-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)benzoate

Systemtic Name: methyl 4-(2-morpholin-4-yl-7-pyridin-3-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)benzoate Openeye Name: methyl 4-[2-morpholino-7-(3-pyridyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]benzoate CAS Name: 4-[2-(4-morpholinyl)-7-(3-pyridinyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-(2-morpholin-4-yl-7-pyridin-3-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)benzoate Traditional Name: 4-[2-morpholino-7-(3-pyridyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]benzoic acid methyl ester Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C3CCN(C3=NC(=N2)N4CCOCC4)C5=CN=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C3CCN(C3=NC(=N2)N4CCOCC4)C5=CN=CC=C5

InChI

InChI=1S/C23H23N5O3/c1-30-22(29)17-6-4-16(5-7-17)20-19-8-10-28(18-3-2-9-24-15-18)21(19)26-23(25-20)27-11-13-31-14-12-27/h2-7,9,15H,8,10-14H2,1H3