4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide Openeye Name: 4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide CAS Name: 4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide IUPAC Name: 4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide Traditional Name: 4-[[3-(2-methoxyphenyl)-2H-pyrazolo[3,4-d]pyrimidin-6-yl]amino]benzenesulfonamide Formula: C18H16N6O3S MolecularWeight: 396.42304

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C3C=NC(=NC3=NN2)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

COC1=CC=CC=C1C2=C3C=NC(=NC3=NN2)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H16N6O3S/c1-27-15-5-3-2-4-13(15)16-14-10-20-18(22-17(14)24-23-16)21-11-6-8-12(9-7-11)28(19,25)26/h2-10H,1H3,(H2,19,25,26)(H2,20,21,22,23,24)