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

Systemtic Name: 3-(3-tert-butyl-1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2,4-dimethylphenyl)-4-ethoxy-benzenesulfonamide Openeye Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2,4-dimethylphenyl)-4-ethoxy-benzenesulfonamide CAS Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2,4-dimethylphenyl)-4-ethoxybenzenesulfonamide IUPAC Name: 3-(3-tert-butyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2,4-dimethylphenyl)-4-ethoxybenzenesulfonamide Traditional Name: 3-(3-tert-butyl-7-keto-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-N-(2,4-dimethylphenyl)-4-ethoxy-benzenesulfonamide Formula: C26H31N5O4S MolecularWeight: 509.62044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C)C)C3=NC(=O)C4=C(N3)C(=NN4C)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C)C)C3=NC(=O)C4=C(N3)C(=NN4C)C(C)(C)C

InChI

InChI=1S/C26H31N5O4S/c1-8-35-20-12-10-17(36(33,34)30-19-11-9-15(2)13-16(19)3)14-18(20)24-27-21-22(25(32)28-24)31(7)29-23(21)26(4,5)6/h9-14,30H,8H2,1-7H3,(H,27,28,32)