3-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-oxidanylpropyl)benzenesulfonamide

Systemtic Name: 3-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-oxidanylpropyl)benzenesulfonamide Openeye Name: 3-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-hydroxypropyl)benzenesulfonamide CAS Name: 3-[(3-bromo-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)amino]-N-(2-hydroxypropyl)benzenesulfonamide IUPAC Name: 3-[(3-bromo-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-hydroxypropyl)benzenesulfonamide Traditional Name: 3-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N-(2-hydroxypropyl)benzenesulfonamide Formula: C21H20BrN5O3S MolecularWeight: 502.3842

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNS(=O)(=O)C1=CC=CC(=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4)O

Isomeric SMILES

CC(CNS(=O)(=O)C1=CC=CC(=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4)O

InChI

InChI=1S/C21H20BrN5O3S/c1-14(28)12-24-31(29,30)17-9-5-8-16(10-17)25-20-11-19(15-6-3-2-4-7-15)26-21-18(22)13-23-27(20)21/h2-11,13-14,24-25,28H,12H2,1H3