3-chloranyl-2,5-dimethyl-N-pyrimidin-4-yl-4-[2,4,6-tris(chloranyl)phenoxy]benzenesulfonamide

Systemtic Name: 3-chloranyl-2,5-dimethyl-N-pyrimidin-4-yl-4-[2,4,6-tris(chloranyl)phenoxy]benzenesulfonamide Openeye Name: 3-chloro-2,5-dimethyl-N-pyrimidin-4-yl-4-(2,4,6-trichlorophenoxy)benzenesulfonamide CAS Name: 3-chloro-2,5-dimethyl-N-(4-pyrimidinyl)-4-(2,4,6-trichlorophenoxy)benzenesulfonamide IUPAC Name: 3-chloro-2,5-dimethyl-N-pyrimidin-4-yl-4-(2,4,6-trichlorophenoxy)benzenesulfonamide Traditional Name: 3-chloro-2,5-dimethyl-N-(4-pyrimidyl)-4-(2,4,6-trichlorophenoxy)benzenesulfonamide Formula: C18H13Cl4N3O3S MolecularWeight: 493.19112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC2=C(C=C(C=C2Cl)Cl)Cl)Cl)C)S(=O)(=O)NC3=NC=NC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1OC2=C(C=C(C=C2Cl)Cl)Cl)Cl)C)S(=O)(=O)NC3=NC=NC=C3

InChI

InChI=1S/C18H13Cl4N3O3S/c1-9-5-14(29(26,27)25-15-3-4-23-8-24-15)10(2)16(22)17(9)28-18-12(20)6-11(19)7-13(18)21/h3-8H,1-2H3,(H,23,24,25)