4-(phenylsulfonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(phenylsulfonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-(4-sulfamoylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Traditional Name: 4-besyl-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Formula: C17H20N4O4S3 MolecularWeight: 440.5601

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4S3/c18-27(22,23)15-8-6-14(7-9-15)19-17(26)20-10-12-21(13-11-20)28(24,25)16-4-2-1-3-5-16/h1-9H,10-13H2,(H,19,26)(H2,18,22,23)