2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(4-methylphenyl)-2-pyridin-4-yl-pyrimidin-4-yl]ethanol

Systemtic Name: 2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(4-methylphenyl)-2-pyridin-4-yl-pyrimidin-4-yl]ethanol Openeye Name: 2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(p-tolyl)-2-(4-pyridyl)pyrimidin-4-yl]ethanol CAS Name: 2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(4-methylphenyl)-2-pyridin-4-yl-4-pyrimidinyl]ethanol IUPAC Name: 2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(4-methylphenyl)-2-pyridin-4-ylpyrimidin-4-yl]ethanol Traditional Name: 2-[6-(1,3-benzodioxol-5-ylsulfamoylamino)-5-(p-tolyl)-2-(4-pyridyl)pyrimidin-4-yl]ethanol Formula: C25H23N5O5S MolecularWeight: 505.54562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N=C2NS(=O)(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=NC=C5)CCO

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N=C2NS(=O)(=O)NC3=CC4=C(C=C3)OCO4)C5=CC=NC=C5)CCO

InChI

InChI=1S/C25H23N5O5S/c1-16-2-4-17(5-3-16)23-20(10-13-31)27-24(18-8-11-26-12-9-18)28-25(23)30-36(32,33)29-19-6-7-21-22(14-19)35-15-34-21/h2-9,11-12,14,29,31H,10,13,15H2,1H3,(H,27,28,30)