N-[2-methylsulfanyl-5-(3-oxidanyl-5-oxidanylidene-cyclohex-3-en-1-yl)phenyl]-N-methylsulfonyl-methanesulfonamide

Systemtic Name: N-[2-methylsulfanyl-5-(3-oxidanyl-5-oxidanylidene-cyclohex-3-en-1-yl)phenyl]-N-methylsulfonyl-methanesulfonamide Openeye Name: N-[5-(3-hydroxy-5-oxo-cyclohex-3-en-1-yl)-2-methylsulfanyl-phenyl]-N-methylsulfonyl-methanesulfonamide CAS Name: N-[5-(3-hydroxy-5-oxo-1-cyclohex-3-enyl)-2-(methylthio)phenyl]-N-methylsulfonylmethanesulfonamide IUPAC Name: N-[5-(3-hydroxy-5-oxocyclohex-3-en-1-yl)-2-methylsulfanylphenyl]-N-methylsulfonylmethanesulfonamide Traditional Name: N-[5-(3-hydroxy-5-keto-cyclohex-3-en-1-yl)-2-(methylthio)phenyl]-N-mesyl-methanesulfonamide Formula: C15H19NO6S3 MolecularWeight: 405.50946

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2CC(=CC(=O)C2)O)N(S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CSC1=C(C=C(C=C1)C2CC(=CC(=O)C2)O)N(S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C15H19NO6S3/c1-23-15-5-4-10(11-6-12(17)9-13(18)7-11)8-14(15)16(24(2,19)20)25(3,21)22/h4-5,8-9,11,17H,6-7H2,1-3H3