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

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloranyl-phenyl]-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]-2,5-dimethyl-benzenesulfonamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-3-chlorophenyl]-2,5-dimethylbenzenesulfonamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-3-chloro-phenyl]-2,5-dimethyl-benzenesulfonamide Formula: C21H17ClN2O2S2 MolecularWeight: 428.95488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C=C2)C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C21H17ClN2O2S2/c1-13-7-8-14(2)20(11-13)28(25,26)24-15-9-10-16(17(22)12-15)21-23-18-5-3-4-6-19(18)27-21/h3-12,24H,1-2H3