N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]pyridine-3-sulfonamide

Systemtic Name: N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]pyridine-3-sulfonamide Openeye Name: N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]pyridine-3-sulfonamide CAS Name: N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]-3-pyridinesulfonamide IUPAC Name: N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]pyridine-3-sulfonamide Traditional Name: N-cyclohexyl-N-methyl-6-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]pyridine-3-sulfonamide Formula: C21H25N3O6S2 MolecularWeight: 479.5697

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CN=C(C=C2)SCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C21H25N3O6S2/c1-23(17-5-3-2-4-6-17)32(27,28)19-7-8-20(22-11-19)31-13-16-10-18(24(25)26)9-15-12-29-14-30-21(15)16/h7-11,17H,2-6,12-14H2,1H3