N-[4-(1,3-benzodioxol-5-yl)-5-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-2-methyl-pyrazol-3-yl]pyridine-2-sulfonamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-5-[2-(5-bromanylpyrimidin-2-yl)oxyethoxy]-2-methyl-pyrazol-3-yl]pyridine-2-sulfonamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)-5-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-2-methyl-pyrazol-3-yl]pyridine-2-sulfonamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-5-[2-[(5-bromo-2-pyrimidinyl)oxy]ethoxy]-2-methyl-3-pyrazolyl]-2-pyridinesulfonamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-5-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-2-methylpyrazol-3-yl]pyridine-2-sulfonamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)-5-[2-(5-bromopyrimidin-2-yl)oxyethoxy]-2-methyl-pyrazol-3-yl]pyridine-2-sulfonamide Formula: C22H19BrN6O6S MolecularWeight: 575.39186

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)OCCOC2=NC=C(C=N2)Br)C3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=N5

Isomeric SMILES

CN1C(=C(C(=N1)OCCOC2=NC=C(C=N2)Br)C3=CC4=C(C=C3)OCO4)NS(=O)(=O)C5=CC=CC=N5

InChI

InChI=1S/C22H19BrN6O6S/c1-29-20(28-36(30,31)18-4-2-3-7-24-18)19(14-5-6-16-17(10-14)35-13-34-16)21(27-29)32-8-9-33-22-25-11-15(23)12-26-22/h2-7,10-12,28H,8-9,13H2,1H3