N-[3-(1,3-dimethyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-phenyl]methanesulfonamide

Systemtic Name: N-[3-(1,3-dimethyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-phenyl]methanesulfonamide Openeye Name: N-[3-(1,3-dimethyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-phenyl]methanesulfonamide CAS Name: N-[3-(1,3-dimethyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxyphenyl]methanesulfonamide IUPAC Name: N-[3-(1,3-dimethyl-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxyphenyl]methanesulfonamide Traditional Name: N-[3-(4-keto-1,3-dimethyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-4-propoxy-phenyl]methanesulfonamide Formula: C17H21N5O4S MolecularWeight: 391.44474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NS(=O)(=O)C)C2=NC(=O)C3=C(NN(C3=N2)C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NS(=O)(=O)C)C2=NC(=O)C3=C(NN(C3=N2)C)C

InChI

InChI=1S/C17H21N5O4S/c1-5-8-26-13-7-6-11(21-27(4,24)25)9-12(13)15-18-16-14(17(23)19-15)10(2)20-22(16)3/h6-7,9,20-21H,5,8H2,1-4H3