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

Systemtic Name: N-butyl-4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Openeye Name: N-butyl-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide CAS Name: N-butyl-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide IUPAC Name: N-butyl-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Traditional Name: N-butyl-4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Formula: C21H29N5O4S MolecularWeight: 447.55106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC)C2=NC(=O)C3=C(N2)C(=NN3C)CCC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC(=C(C=C1)OCC)C2=NC(=O)C3=C(N2)C(=NN3C)CCC

InChI

InChI=1S/C21H29N5O4S/c1-5-8-12-22-31(28,29)14-10-11-17(30-7-3)15(13-14)20-23-18-16(9-6-2)25-26(4)19(18)21(27)24-20/h10-11,13,22H,5-9,12H2,1-4H3,(H,23,24,27)