4-azanyl-3-chloranyl-benzenesulfonamide; 2-bromanyl-N-(2-chloranyl-4-sulfamoyl-phenyl)propanamide

Systemtic Name: 4-azanyl-3-chloranyl-benzenesulfonamide; 2-bromanyl-N-(2-chloranyl-4-sulfamoyl-phenyl)propanamide Openeye Name: 4-amino-3-chloro-benzenesulfonamide; 2-bromo-N-(2-chloro-4-sulfamoyl-phenyl)propanamide CAS Name: 4-amino-3-chlorobenzenesulfonamide; 2-bromo-N-(2-chloro-4-sulfamoylphenyl)propanamide IUPAC Name: 4-amino-3-chlorobenzenesulfonamide; 2-bromo-N-(2-chloro-4-sulfamoylphenyl)propanamide Traditional Name: 4-amino-3-chloro-benzenesulfonamide; 2-bromo-N-(2-chloro-4-sulfamoyl-phenyl)propionamide Formula: C15H17BrCl2N4O5S2 MolecularWeight: 548.25928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)S(=O)(=O)N)Cl)Br.C1=CC(=C(C=C1S(=O)(=O)N)Cl)N

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)S(=O)(=O)N)Cl)Br.C1=CC(=C(C=C1S(=O)(=O)N)Cl)N

InChI

InChI=1S/C9H10BrClN2O3S.C6H7ClN2O2S/c1-5(10)9(14)13-8-3-2-6(4-7(8)11)17(12,15)16;7-5-3-4(12(9,10)11)1-2-6(5)8/h2-5H,1H3,(H,13,14)(H2,12,15,16);1-3H,8H2,(H2,9,10,11)