4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide

Systemtic Name: 4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide Openeye Name: 4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide CAS Name: 4-[(3-bromo-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide IUPAC Name: 4-[(3-bromo-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide Traditional Name: 4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]-N,N-bis(2-hydroxyethyl)benzenesulfonamide Formula: C22H22BrN5O4S MolecularWeight: 532.41018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)NC4=CC=C(C=C4)S(=O)(=O)N(CCO)CCO)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=NN3C(=C2)NC4=CC=C(C=C4)S(=O)(=O)N(CCO)CCO)Br

InChI

InChI=1S/C22H22BrN5O4S/c23-19-15-24-28-21(14-20(26-22(19)28)16-4-2-1-3-5-16)25-17-6-8-18(9-7-17)33(31,32)27(10-12-29)11-13-30/h1-9,14-15,25,29-30H,10-13H2