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

Systemtic Name: 4-chloranyl-3-(3,4-dimethoxyphenyl)-2-(2-hydroxyethyloxy)-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-chloro-3-(3,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-chloro-3-(3,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-chloro-3-(3,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-chloro-3-(3,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)-N-(4-pyrimidyl)benzenesulfonamide Formula: C20H20ClN3O6S MolecularWeight: 465.9073

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C=CC(=C2OCCO)S(=O)(=O)NC3=NC=NC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C=CC(=C2OCCO)S(=O)(=O)NC3=NC=NC=C3)Cl)OC

InChI

InChI=1S/C20H20ClN3O6S/c1-28-15-5-3-13(11-16(15)29-2)19-14(21)4-6-17(20(19)30-10-9-25)31(26,27)24-18-7-8-22-12-23-18/h3-8,11-12,25H,9-10H2,1-2H3,(H,22,23,24)