N-[6-(2-hydroxyethyloxy)-5-(2-methylsulfanylphenoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: N-[6-(2-hydroxyethyloxy)-5-(2-methylsulfanylphenoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: N-[6-(2-hydroxyethoxy)-5-(2-methylsulfanylphenoxy)pyrimidin-4-yl]benzenesulfonamide CAS Name: N-[6-(2-hydroxyethoxy)-5-[2-(methylthio)phenoxy]-4-pyrimidinyl]benzenesulfonamide IUPAC Name: N-[6-(2-hydroxyethoxy)-5-(2-methylsulfanylphenoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: N-[6-(2-hydroxyethoxy)-5-[2-(methylthio)phenoxy]pyrimidin-4-yl]benzenesulfonamide Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1OC2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=CC=C1OC2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O5S2/c1-28-16-10-6-5-9-15(16)27-17-18(20-13-21-19(17)26-12-11-23)22-29(24,25)14-7-3-2-4-8-14/h2-10,13,23H,11-12H2,1H3,(H,20,21,22)