4-[(2-chlorophenyl)methyl]-N-[4-(phenethylsulfamoyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-[(2-chlorophenyl)methyl]-N-[4-(phenethylsulfamoyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-[(2-chlorophenyl)methyl]-N-[4-(phenethylsulfamoyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-[(2-chlorophenyl)methyl]-N-[4-(phenethylsulfamoyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(2-chlorophenyl)methyl]-N-[4-(phenethylsulfamoyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(2-chlorobenzyl)-N-[4-(phenethylsulfamoyl)phenyl]piperazine-1-carbothioamide Formula: C26H29ClN4O2S2 MolecularWeight: 529.11706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C(=S)NC3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H29ClN4O2S2/c27-25-9-5-4-8-22(25)20-30-16-18-31(19-17-30)26(34)29-23-10-12-24(13-11-23)35(32,33)28-15-14-21-6-2-1-3-7-21/h1-13,28H,14-20H2,(H,29,34)