2-(benzimidazol-1-yl)-N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]ethanamide

Systemtic Name: 2-(benzimidazol-1-yl)-N-[2-(6-ethylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl]ethanamide Openeye Name: 2-(benzimidazol-1-yl)-N-[2-[6-ethylsulfanyl-4-(1-piperidyl)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]acetamide CAS Name: 2-(1-benzimidazolyl)-N-[2-[6-(ethylthio)-4-(1-piperidinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]acetamide IUPAC Name: 2-(benzimidazol-1-yl)-N-[2-(6-ethylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidin-1-yl)ethyl]acetamide Traditional Name: 2-(benzimidazol-1-yl)-N-[2-[6-(ethylthio)-4-piperidino-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]acetamide Formula: C23H28N8OS MolecularWeight: 464.58642

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)CN3C=NC4=CC=CC=C43)C(=N1)N5CCCCC5

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)CN3C=NC4=CC=CC=C43)C(=N1)N5CCCCC5

InChI

InChI=1S/C23H28N8OS/c1-2-33-23-27-21(29-11-6-3-7-12-29)17-14-26-31(22(17)28-23)13-10-24-20(32)15-30-16-25-18-8-4-5-9-19(18)30/h4-5,8-9,14,16H,2-3,6-7,10-13,15H2,1H3,(H,24,32)