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

Systemtic Name: 7-methoxy-N-[2-(6-methylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1-benzofuran-2-carboxamide Openeye Name: 7-methoxy-N-[2-[6-methylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]benzofuran-2-carboxamide CAS Name: 7-methoxy-N-[2-[6-(methylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-benzofurancarboxamide IUPAC Name: 7-methoxy-N-[2-(6-methylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 7-methoxy-N-[2-[6-(methylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]coumarilamide Formula: C23H26N6O3S MolecularWeight: 466.55594

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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)N5CCCCC5

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)NCCN3C4=C(C=N3)C(=NC(=N4)SC)N5CCCCC5

InChI

InChI=1S/C23H26N6O3S/c1-31-17-8-6-7-15-13-18(32-19(15)17)22(30)24-9-12-29-21-16(14-25-29)20(26-23(27-21)33-2)28-10-4-3-5-11-28/h6-8,13-14H,3-5,9-12H2,1-2H3,(H,24,30)