3-bromanyl-N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide

Systemtic Name: 3-bromanyl-N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Openeye Name: 3-bromo-N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide CAS Name: 3-bromo-N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]propanamide IUPAC Name: 3-bromo-N-[2-[6-ethylsulfanyl-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Traditional Name: 3-bromo-N-[2-[6-(ethylthio)-4-(2-methoxyethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propionamide Formula: C15H23BrN6O2S MolecularWeight: 431.35112

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)CCBr)C(=N1)NCCOC

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)CCBr)C(=N1)NCCOC

InChI

InChI=1S/C15H23BrN6O2S/c1-3-25-15-20-13(18-7-9-24-2)11-10-19-22(14(11)21-15)8-6-17-12(23)4-5-16/h10H,3-9H2,1-2H3,(H,17,23)(H,18,20,21)