2-[[5-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxy-pyridin-3-yl]sulfamoyl]ethanoic acid

Systemtic Name: 2-[[5-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxy-pyridin-3-yl]sulfamoyl]ethanoic acid Openeye Name: 2-[[5-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxy-3-pyridyl]sulfamoyl]acetic acid CAS Name: 2-[[5-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxy-3-pyridinyl]sulfamoyl]acetic acid IUPAC Name: 2-[[5-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxypyridin-3-yl]sulfamoyl]acetic acid Traditional Name: 2-[[5-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-6-propoxy-3-pyridyl]sulfamoyl]acetic acid Formula: C19H24N6O6S MolecularWeight: 464.49546

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC(=CN=C3OCCC)NS(=O)(=O)CC(=O)O)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=CC(=CN=C3OCCC)NS(=O)(=O)CC(=O)O)C

InChI

InChI=1S/C19H24N6O6S/c1-4-6-13-15-16(25(3)23-13)18(28)22-17(21-15)12-8-11(9-20-19(12)31-7-5-2)24-32(29,30)10-14(26)27/h8-9,24H,4-7,10H2,1-3H3,(H,26,27)(H,21,22,28)