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

Systemtic Name: 4-ethoxy-N-ethyl-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(3-oxidanylpropyl)benzenesulfonamide Openeye Name: 4-ethoxy-N-ethyl-N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide CAS Name: 4-ethoxy-N-ethyl-N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide IUPAC Name: 4-ethoxy-N-ethyl-N-(3-hydroxypropyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Traditional Name: 4-ethoxy-N-ethyl-N-(3-hydroxypropyl)-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide Formula: C22H31N5O5S MolecularWeight: 477.57704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CC)CCCO)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CC)CCCO)OCC)C

InChI

InChI=1S/C22H31N5O5S/c1-5-9-17-19-20(26(4)25-17)22(29)24-21(23-19)16-14-15(10-11-18(16)32-7-3)33(30,31)27(6-2)12-8-13-28/h10-11,14,28H,5-9,12-13H2,1-4H3,(H,23,24,29)