3-[(2-methylsulfonylphenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]-N-oxidanyl-propanamide

Systemtic Name: 3-[(2-methylsulfonylphenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]-N-oxidanyl-propanamide Openeye Name: 3-[(2-methylsulfonylphenyl)sulfonyl-[2-(6-thioxocyclohexa-1,3-dien-1-yl)ethyl]amino]propanehydroxamic acid CAS Name: N-hydroxy-3-[(2-methylsulfonylphenyl)sulfonyl-[2-(6-sulfanylidene-1-cyclohexa-1,3-dienyl)ethyl]amino]propanamide IUPAC Name: N-hydroxy-3-[(2-methylsulfonylphenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]propanamide Traditional Name: 3-[(2-mesylphenyl)sulfonyl-[2-(6-thioxocyclohexa-1,3-dien-1-yl)ethyl]amino]propanehydroxamic acid Formula: C18H22N2O6S3 MolecularWeight: 458.57208

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N(CCC2=CC=CCC2=S)CCC(=O)NO

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)N(CCC2=CC=CCC2=S)CCC(=O)NO

InChI

InChI=1S/C18H22N2O6S3/c1-28(23,24)16-8-4-5-9-17(16)29(25,26)20(13-11-18(21)19-22)12-10-14-6-2-3-7-15(14)27/h2-6,8-9,22H,7,10-13H2,1H3,(H,19,21)