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

Systemtic Name: 3-bromanyl-N-[2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Openeye Name: 3-bromo-N-[2-[6-ethylsulfanyl-4-(isopropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide CAS Name: 3-bromo-N-[2-[6-(ethylthio)-4-(propan-2-ylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]propanamide IUPAC Name: 3-bromo-N-[2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propanamide Traditional Name: 3-bromo-N-[2-[6-(ethylthio)-4-(isopropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]propionamide Formula: C15H23BrN6OS MolecularWeight: 415.35172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23BrN6OS/c1-4-24-15-20-13(19-10(2)3)11-9-18-22(14(11)21-15)8-7-17-12(23)5-6-16/h9-10H,4-8H2,1-3H3,(H,17,23)(H,19,20,21)