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

Systemtic Name: N-[3-chloranyl-4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-methyl-benzenesulfonamide Openeye Name: N-[3-chloro-4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-methyl-benzenesulfonamide CAS Name: N-[3-chloro-4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-methylbenzenesulfonamide IUPAC Name: N-[3-chloro-4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-methylbenzenesulfonamide Traditional Name: N-[3-chloro-4-(6-methoxy-1,3-benzothiazol-2-yl)phenyl]-3-methyl-benzenesulfonamide Formula: C21H17ClN2O3S2 MolecularWeight: 444.95428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2)C3=NC4=C(S3)C=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=CC=C1)S(=O)(=O)NC2=CC(=C(C=C2)C3=NC4=C(S3)C=C(C=C4)OC)Cl

InChI

InChI=1S/C21H17ClN2O3S2/c1-13-4-3-5-16(10-13)29(25,26)24-14-6-8-17(18(22)11-14)21-23-19-9-7-15(27-2)12-20(19)28-21/h3-12,24H,1-2H3