3,4-dimethoxy-N'-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]benzohydrazide

Systemtic Name: 3,4-dimethoxy-N'-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]benzohydrazide Openeye Name: 3,4-dimethoxy-N'-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]benzohydrazide CAS Name: 3,4-dimethoxy-N'-[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethyl]benzohydrazide IUPAC Name: 3,4-dimethoxy-N'-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]benzohydrazide Traditional Name: 3,4-dimethoxy-N'-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]benzohydrazide Formula: C22H20N6O4S MolecularWeight: 464.497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NNC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NNC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4)OC

InChI

InChI=1S/C22H20N6O4S/c1-31-17-9-8-14(10-18(17)32-2)21(30)27-26-19(29)12-33-22-16-11-25-28(20(16)23-13-24-22)15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,26,29)(H,27,30)