2,5-dimethyl-N-[4-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[4-(4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[4-(4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzenesulfonamide Traditional Name: N-[4-(4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)phenyl]-2,5-dimethyl-benzenesulfonamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)N3C4=NC=NC(=O)C4=CN3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=C(C=C2)N3C4=NC=NC(=O)C4=CN3

InChI

InChI=1S/C19H17N5O3S/c1-12-3-4-13(2)17(9-12)28(26,27)23-14-5-7-15(8-6-14)24-18-16(10-22-24)19(25)21-11-20-18/h3-11,22-23H,1-2H3