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

Systemtic Name: 4-chloranyl-2-(2-hydroxyethyloxy)-3-(4-nitrophenyl)-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-nitrophenyl)-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-nitrophenyl)-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-nitrophenyl)-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-chloro-2-(2-hydroxyethoxy)-3-(4-nitrophenyl)-N-(4-pyrimidyl)benzenesulfonamide Formula: C18H15ClN4O6S MolecularWeight: 450.8529

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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)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C=CC(=C2OCCO)S(=O)(=O)NC3=NC=NC=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClN4O6S/c19-14-5-6-15(30(27,28)22-16-7-8-20-11-21-16)18(29-10-9-24)17(14)12-1-3-13(4-2-12)23(25)26/h1-8,11,24H,9-10H2,(H,20,21,22)