3-(6-ethyl-5-oxidanylidene-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-pyridin-4-yl-benzenesulfonamide

Systemtic Name: 3-(6-ethyl-5-oxidanylidene-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-pyridin-4-yl-benzenesulfonamide Openeye Name: 3-(6-ethyl-5-oxo-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-(4-pyridyl)benzenesulfonamide CAS Name: 3-(6-ethyl-5-oxo-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-pyridin-4-ylbenzenesulfonamide IUPAC Name: 3-(6-ethyl-5-oxo-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-pyridin-4-ylbenzenesulfonamide Traditional Name: 3-(6-ethyl-5-keto-1H-[1,2,4]triazolo[3,4-f]purin-8-yl)-4-propoxy-N-(4-pyridyl)benzenesulfonamide Formula: C22H22N8O4S MolecularWeight: 494.52628

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=NC=C2)C3=NC4=C5NN=CN5C(=O)N(C4=N3)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=NC=C2)C3=NC4=C5NN=CN5C(=O)N(C4=N3)CC

InChI

InChI=1S/C22H22N8O4S/c1-3-11-34-17-6-5-15(35(32,33)28-14-7-9-23-10-8-14)12-16(17)19-25-18-20(26-19)29(4-2)22(31)30-13-24-27-21(18)30/h5-10,12-13,27H,3-4,11H2,1-2H3,(H,23,28)