7-methoxy-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 7-methoxy-N-[2-(6-methylsulfanyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1-benzofuran-2-carboxamide Openeye Name: 7-methoxy-N-[2-(6-methylsulfanyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]benzofuran-2-carboxamide CAS Name: 7-methoxy-N-[2-[6-(methylthio)-4-(4-morpholinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-benzofurancarboxamide IUPAC Name: 7-methoxy-N-[2-(6-methylsulfanyl-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 7-methoxy-N-[2-[6-(methylthio)-4-morpholino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]coumarilamide Formula: C22H24N6O4S MolecularWeight: 468.52876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)NCCN3C4=C(C=N3)C(=NC(=N4)SC)N5CCOCC5

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)NCCN3C4=C(C=N3)C(=NC(=N4)SC)N5CCOCC5

InChI

InChI=1S/C22H24N6O4S/c1-30-16-5-3-4-14-12-17(32-18(14)16)21(29)23-6-7-28-20-15(13-24-28)19(25-22(26-20)33-2)27-8-10-31-11-9-27/h3-5,12-13H,6-11H2,1-2H3,(H,23,29)