N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]acetamide CAS Name: N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-3-pyrazolyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]acetamide Traditional Name: 2-(benzylthio)-N-[2-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-5-methyl-pyrazol-3-yl]acetamide Formula: C24H21N7O2S MolecularWeight: 471.53424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSCC2=CC=CC=C2)C3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSCC2=CC=CC=C2)C3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

InChI

InChI=1S/C24H21N7O2S/c1-16-12-20(26-21(32)15-34-14-17-8-4-2-5-9-17)31(29-16)24-27-22-19(23(33)28-24)13-25-30(22)18-10-6-3-7-11-18/h2-13,25H,14-15H2,1H3,(H,26,32)