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

Systemtic Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyl-oxane-4-carboxamide Openeye Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyl-tetrahydropyran-4-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(1-pyrrolidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-4-phenyl-4-oxanecarboxamide IUPAC Name: N-[2-(6-ethylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]-4-phenyloxane-4-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-phenyl-tetrahydropyran-4-carboxamide Formula: C25H32N6O2S MolecularWeight: 480.62558

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)C(=N1)N5CCCC5

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3(CCOCC3)C4=CC=CC=C4)C(=N1)N5CCCC5

InChI

InChI=1S/C25H32N6O2S/c1-2-34-24-28-21(30-13-6-7-14-30)20-18-27-31(22(20)29-24)15-12-26-23(32)25(10-16-33-17-11-25)19-8-4-3-5-9-19/h3-5,8-9,18H,2,6-7,10-17H2,1H3,(H,26,32)