1-(5-chloranyl-2,4-disulfamoyl-phenyl)-3-(4-sulfamoylphenyl)thiourea

Systemtic Name: 1-(5-chloranyl-2,4-disulfamoyl-phenyl)-3-(4-sulfamoylphenyl)thiourea Openeye Name: 1-(5-chloro-2,4-disulfamoyl-phenyl)-3-(4-sulfamoylphenyl)thiourea CAS Name: 1-(5-chloro-2,4-disulfamoylphenyl)-3-(4-sulfamoylphenyl)thiourea IUPAC Name: 1-(5-chloro-2,4-disulfamoylphenyl)-3-(4-sulfamoylphenyl)thiourea Traditional Name: 1-(5-chloro-2,4-disulfamoyl-phenyl)-3-(4-sulfamoylphenyl)thiourea Formula: C13H14ClN5O6S4 MolecularWeight: 499.99316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Cl)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NC2=CC(=C(C=C2S(=O)(=O)N)S(=O)(=O)N)Cl)S(=O)(=O)N

InChI

InChI=1S/C13H14ClN5O6S4/c14-9-5-10(12(29(17,24)25)6-11(9)28(16,22)23)19-13(26)18-7-1-3-8(4-2-7)27(15,20)21/h1-6H,(H2,15,20,21)(H2,16,22,23)(H2,17,24,25)(H2,18,19,26)