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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloranyl-phenyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-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=CC=CC=C4S3)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)Cl

InChI

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