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

Systemtic Name: 3-bromanyl-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Openeye Name: 3-bromo-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide CAS Name: 3-bromo-N-[2-[4-(2-methoxyethylamino)-6-(methylthio)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]propanamide IUPAC Name: 3-bromo-N-[2-[4-(2-methoxyethylamino)-6-methylsulfanylpyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Traditional Name: 3-bromo-N-[2-[4-(2-methoxyethylamino)-6-(methylthio)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propionamide Formula: C14H21BrN6O2S MolecularWeight: 417.32454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)CCBr)SC

Isomeric SMILES

COCCNC1=NC(=NC2=C1C=NN2CCNC(=O)CCBr)SC

InChI

InChI=1S/C14H21BrN6O2S/c1-23-8-6-17-12-10-9-18-21(7-5-16-11(22)3-4-15)13(10)20-14(19-12)24-2/h9H,3-8H2,1-2H3,(H,16,22)(H,17,19,20)