4-[[5-(2-ethoxyphenyl)-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenesulfonamide

Systemtic Name: 4-[[5-(2-ethoxyphenyl)-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenesulfonamide Openeye Name: 4-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenesulfonamide CAS Name: 4-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenesulfonamide IUPAC Name: 4-[[5-(2-ethoxyphenyl)-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl]methyl]benzenesulfonamide Traditional Name: 4-[(7-keto-5-o-phenetyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-1-yl)methyl]benzenesulfonamide Formula: C23H25N5O4S MolecularWeight: 467.5407

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC=CC=C3OCC)CC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H25N5O4S/c1-3-7-18-20-21(28(27-18)14-15-10-12-16(13-11-15)33(24,30)31)23(29)26-22(25-20)17-8-5-6-9-19(17)32-4-2/h5-6,8-13H,3-4,7,14H2,1-2H3,(H2,24,30,31)(H,25,26,29)