4-[[2,6-bis(chloranyl)phenyl]methyl]-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[[2,6-bis(chloranyl)phenyl]methyl]-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide CAS Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-sulfamoylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(2,6-dichlorophenyl)methyl]-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,6-dichlorobenzyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Formula: C18H20Cl2N4O2S2 MolecularWeight: 459.413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H20Cl2N4O2S2/c19-16-2-1-3-17(20)15(16)12-23-8-10-24(11-9-23)18(27)22-13-4-6-14(7-5-13)28(21,25)26/h1-7H,8-12H2,(H,22,27)(H2,21,25,26)