N-[4-(6-chloranyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-(6-chloranyl-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[4-(6-chloro-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-(6-chloro-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[4-(6-chloro-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[4-(6-chloro-1,3-benzothiazol-2-yl)phenyl]-2,5-dimethoxy-benzenesulfonamide Formula: C21H17ClN2O4S2 MolecularWeight: 460.95368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN2O4S2/c1-27-16-8-10-18(28-2)20(12-16)30(25,26)24-15-6-3-13(4-7-15)21-23-17-9-5-14(22)11-19(17)29-21/h3-12,24H,1-2H3