N-(1,3-benzothiazol-6-yl)-4-(3-chloranyl-2-cyano-phenoxy)benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-4-(3-chloranyl-2-cyano-phenoxy)benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-6-yl)-4-(3-chloro-2-cyano-phenoxy)benzenesulfonamide CAS Name: N-(1,3-benzothiazol-6-yl)-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-4-(3-chloro-2-cyanophenoxy)benzenesulfonamide Traditional Name: N-(1,3-benzothiazol-6-yl)-4-(3-chloro-2-cyano-phenoxy)benzenesulfonamide Formula: C20H12ClN3O3S2 MolecularWeight: 441.91058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C#N)OC2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C#N)OC2=CC=C(C=C2)S(=O)(=O)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C20H12ClN3O3S2/c21-17-2-1-3-19(16(17)11-22)27-14-5-7-15(8-6-14)29(25,26)24-13-4-9-18-20(10-13)28-12-23-18/h1-10,12,24H