3-(3-tert-butyl-1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-oxidanylpropyl)benzenesulfonamide

Systemtic Name: 3-(3-tert-butyl-1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-oxidanylpropyl)benzenesulfonamide Openeye Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-hydroxypropyl)benzenesulfonamide CAS Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-hydroxypropyl)benzenesulfonamide IUPAC Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-hydroxypropyl)benzenesulfonamide Traditional Name: 3-(3-tert-butyl-7-keto-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxy-N,N-bis(2-hydroxypropyl)benzenesulfonamide Formula: C24H35N5O6S MolecularWeight: 521.6296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N(CC(C)O)CC(C)O)C2=NC(=O)C3=C(N2)C(=NN3C)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N(CC(C)O)CC(C)O)C2=NC(=O)C3=C(N2)C(=NN3C)C(C)(C)C

InChI

InChI=1S/C24H35N5O6S/c1-8-35-18-10-9-16(36(33,34)29(12-14(2)30)13-15(3)31)11-17(18)22-25-19-20(23(32)26-22)28(7)27-21(19)24(4,5)6/h9-11,14-15,30-31H,8,12-13H2,1-7H3,(H,25,26,32)