4-(dimethylsulfamoyl)-N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanoyl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[1-oxo-2-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethyl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[2-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetyl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-[2-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetyl]benzamide Formula: C22H20N6O4S2 MolecularWeight: 496.562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H20N6O4S2/c1-27(2)34(31,32)17-10-8-15(9-11-17)21(30)26-19(29)13-33-22-18-12-25-28(20(18)23-14-24-22)16-6-4-3-5-7-16/h3-12,14H,13H2,1-2H3,(H,26,29,30)