S-[2-[[4-(ethanoylsulfamoyl)phenyl]carbamoyl]phenyl] 5-bromanylpentanethioate

Systemtic Name: S-[2-[[4-(ethanoylsulfamoyl)phenyl]carbamoyl]phenyl] 5-bromanylpentanethioate Openeye Name: S-[2-[[4-(acetylsulfamoyl)phenyl]carbamoyl]phenyl] 5-bromopentanethioate CAS Name: 5-bromopentanethioic acid S-[2-[[4-(acetylsulfamoyl)anilino]-oxomethyl]phenyl] ester IUPAC Name: S-[2-[[4-(acetylsulfamoyl)phenyl]carbamoyl]phenyl] 5-bromopentanethioate Traditional Name: 5-bromopentanethioic acid S-[2-[[4-(acetylsulfamoyl)phenyl]carbamoyl]phenyl] ester Formula: C20H21BrN2O5S2 MolecularWeight: 513.42514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC(=O)CCCCBr

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SC(=O)CCCCBr

InChI

InChI=1S/C20H21BrN2O5S2/c1-14(24)23-30(27,28)16-11-9-15(10-12-16)22-20(26)17-6-2-3-7-18(17)29-19(25)8-4-5-13-21/h2-3,6-7,9-12H,4-5,8,13H2,1H3,(H,22,26)(H,23,24)