6-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-dimethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-dimethyl-pyridine-3-sulfonamide Openeye Name: 6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-dimethyl-pyridine-3-sulfonamide CAS Name: 6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-N,N-dimethyl-3-pyridinesulfonamide IUPAC Name: 6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N,N-dimethylpyridine-3-sulfonamide Traditional Name: 6-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-N,N-dimethyl-pyridine-3-sulfonamide Formula: C16H17ClN2O4S2 MolecularWeight: 400.90018

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C16H17ClN2O4S2/c1-19(2)25(20,21)14-3-4-15(18-7-14)24-9-12-6-13(17)5-11-8-22-10-23-16(11)12/h3-7H,8-10H2,1-2H3