N-[2-[6-ethylsulfanyl-4-(2-methylpropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide

Systemtic Name: N-[2-[6-ethylsulfanyl-4-(2-methylpropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide Openeye Name: N-[2-[6-ethylsulfanyl-4-(isobutylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide CAS Name: N-[2-[6-(ethylthio)-4-(2-methylpropylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide IUPAC Name: N-[2-[6-ethylsulfanyl-4-(2-methylpropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide Traditional Name: N-[2-[6-(ethylthio)-4-(isobutylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-3-phenyl-1H-pyrazole-5-carboxamide Formula: C23H28N8OS MolecularWeight: 464.58642

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC(=NN3)C4=CC=CC=C4)C(=N1)NCC(C)C

Isomeric SMILES

CCSC1=NC2=C(C=NN2CCNC(=O)C3=CC(=NN3)C4=CC=CC=C4)C(=N1)NCC(C)C

InChI

InChI=1S/C23H28N8OS/c1-4-33-23-27-20(25-13-15(2)3)17-14-26-31(21(17)28-23)11-10-24-22(32)19-12-18(29-30-19)16-8-6-5-7-9-16/h5-9,12,14-15H,4,10-11,13H2,1-3H3,(H,24,32)(H,29,30)(H,25,27,28)