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

Systemtic Name: N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyl-oxane-4-carboxamide Openeye Name: N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-[2-[4-(2-methoxyethylamino)-6-(methylthio)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-phenyl-4-oxanecarboxamide IUPAC Name: N-[2-[4-(2-methoxyethylamino)-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyloxane-4-carboxamide Traditional Name: N-[2-[4-(2-methoxyethylamino)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyl-tetrahydropyran-4-carboxamide Formula: C23H30N6O3S MolecularWeight: 470.5877

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)SC

Isomeric SMILES

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)SC

InChI

InChI=1S/C23H30N6O3S/c1-31-15-11-24-19-18-16-26-29(20(18)28-22(27-19)33-2)12-10-25-21(30)23(8-13-32-14-9-23)17-6-4-3-5-7-17/h3-7,16H,8-15H2,1-2H3,(H,25,30)(H,24,27,28)