4-chloranyl-2-(2-hydroxyethyloxy)-3-(4-hydroxyphenyl)-N-pyrimidin-4-yl-benzenesulfonamide

Systemtic Name: 4-chloranyl-2-(2-hydroxyethyloxy)-3-(4-hydroxyphenyl)-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-hydroxyphenyl)-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-hydroxyphenyl)-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-hydroxyphenyl)-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-hydroxyphenyl)-N-(4-pyrimidyl)benzenesulfonamide Formula: C18H16ClN3O5S MolecularWeight: 421.85474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C=CC(=C2OCCO)S(=O)(=O)NC3=NC=NC=C3)Cl)O

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=CC(=C2OCCO)S(=O)(=O)NC3=NC=NC=C3)Cl)O

InChI

InChI=1S/C18H16ClN3O5S/c19-14-5-6-15(28(25,26)22-16-7-8-20-11-21-16)18(27-10-9-23)17(14)12-1-3-13(24)4-2-12/h1-8,11,23-24H,9-10H2,(H,20,21,22)