4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)-N-phenyl-benzenesulfonamide

Systemtic Name: 4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)-N-phenyl-benzenesulfonamide Openeye Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-morpholinoethyl)-N-phenyl-benzenesulfonamide CAS Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-[2-(4-morpholinyl)ethyl]-N-phenylbenzenesulfonamide IUPAC Name: 4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-morpholin-4-ylethyl)-N-phenylbenzenesulfonamide Traditional Name: 4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2-morpholinoethyl)-N-phenyl-benzenesulfonamide Formula: C29H36N6O5S MolecularWeight: 580.69834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCN4CCOCC4)C5=CC=CC=C5)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCN4CCOCC4)C5=CC=CC=C5)OCC)C

InChI

InChI=1S/C29H36N6O5S/c1-4-9-24-26-27(33(3)32-24)29(36)31-28(30-26)23-20-22(12-13-25(23)40-5-2)41(37,38)35(21-10-7-6-8-11-21)15-14-34-16-18-39-19-17-34/h6-8,10-13,20H,4-5,9,14-19H2,1-3H3,(H,30,31,36)