3-[(4-acetamidophenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]-N-oxidanyl-propanamide

Systemtic Name: 3-[(4-acetamidophenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]-N-oxidanyl-propanamide Openeye Name: N-[4-[[3-(hydroxyamino)-3-oxo-propyl]-[2-(6-thioxocyclohexa-1,3-dien-1-yl)ethyl]sulfamoyl]phenyl]acetamide CAS Name: 3-[(4-acetamidophenyl)sulfonyl-[2-(6-sulfanylidene-1-cyclohexa-1,3-dienyl)ethyl]amino]-N-hydroxypropanamide IUPAC Name: 3-[(4-acetamidophenyl)sulfonyl-[2-(6-sulfanylidenecyclohexa-1,3-dien-1-yl)ethyl]amino]-N-hydroxypropanamide Traditional Name: N-[4-[[3-(hydroxyamino)-3-keto-propyl]-[2-(6-thioxocyclohexa-1,3-dien-1-yl)ethyl]sulfamoyl]phenyl]acetamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CCC2=S)CCC(=O)NO

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CCC2=S)CCC(=O)NO

InChI

InChI=1S/C19H23N3O5S2/c1-14(23)20-16-6-8-17(9-7-16)29(26,27)22(13-11-19(24)21-25)12-10-15-4-2-3-5-18(15)28/h2-4,6-9,25H,5,10-13H2,1H3,(H,20,23)(H,21,24)