N-(1,3-benzothiazol-2-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-(phenylsulfonylamino)phenyl]sulfanyl-ethanamide Openeye Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[4-(benzenesulfonamido)phenyl]sulfanyl-N-(1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[[4-(benzenesulfonamido)phenyl]thio]-N-(1,3-benzothiazol-2-yl)acetamide Formula: C21H17N3O3S3 MolecularWeight: 455.57298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17N3O3S3/c25-20(23-21-22-18-8-4-5-9-19(18)29-21)14-28-16-12-10-15(11-13-16)24-30(26,27)17-6-2-1-3-7-17/h1-13,24H,14H2,(H,22,23,25)