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

Systemtic Name: N-[2-(6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyl-oxane-4-carboxamide Openeye Name: N-[2-(6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-[2-[6-(methylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-phenyl-4-oxanecarboxamide IUPAC Name: N-[2-(6-methylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyloxane-4-carboxamide Traditional Name: N-[2-[6-(methylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyl-tetrahydropyran-4-carboxamide Formula: C24H30N6O2S MolecularWeight: 466.599

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)C(=N1)N5CCCC5

Isomeric SMILES

CSC1=NC2=C(C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)C(=N1)N5CCCC5

InChI

InChI=1S/C24H30N6O2S/c1-33-23-27-20(29-12-5-6-13-29)19-17-26-30(21(19)28-23)14-11-25-22(31)24(9-15-32-16-10-24)18-7-3-2-4-8-18/h2-4,7-8,17H,5-6,9-16H2,1H3,(H,25,31)