4-bromanyl-N-(3-oxidanylpropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(3-oxidanylpropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide CAS Name: 4-bromo-N-(3-hydroxypropyl)-N-(2-phenyl-3-pyrazolyl)benzenesulfonamide IUPAC Name: 4-bromo-N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(3-hydroxypropyl)-N-(2-phenylpyrazol-3-yl)benzenesulfonamide Formula: C18H18BrN3O3S MolecularWeight: 436.32282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC=N2)N(CCCO)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC=N2)N(CCCO)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O3S/c19-15-7-9-17(10-8-15)26(24,25)21(13-4-14-23)18-11-12-20-22(18)16-5-2-1-3-6-16/h1-3,5-12,23H,4,13-14H2