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

Systemtic Name: 7-methoxy-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-benzofuran-2-carboxamide Openeye Name: 7-methoxy-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]benzofuran-2-carboxamide CAS Name: 7-methoxy-N-[2-[4-(2-methoxyethylamino)-6-(methylthio)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-2-benzofurancarboxamide IUPAC Name: 7-methoxy-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-1-benzofuran-2-carboxamide Traditional Name: 7-methoxy-N-[2-[4-(2-methoxyethylamino)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]coumarilamide Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=CC4=C(O3)C(=CC=C4)OC)SC

Isomeric SMILES

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=CC4=C(O3)C(=CC=C4)OC)SC

InChI

InChI=1S/C21H24N6O4S/c1-29-10-8-22-18-14-12-24-27(19(14)26-21(25-18)32-3)9-7-23-20(28)16-11-13-5-4-6-15(30-2)17(13)31-16/h4-6,11-12H,7-10H2,1-3H3,(H,23,28)(H,22,25,26)