4-(3-bromophenyl)sulfonyl-N-phenyl-piperazine-1-carbothioamide

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-phenyl-piperazine-1-carbothioamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-phenyl-piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-phenyl-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-phenylpiperazine-1-carbothioamide Traditional Name: 4-(3-bromophenyl)sulfonyl-N-phenyl-piperazine-1-carbothioamide Formula: C17H18BrN3O2S2 MolecularWeight: 440.37772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C(=S)NC2=CC=CC=C2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H18BrN3O2S2/c18-14-5-4-8-16(13-14)25(22,23)21-11-9-20(10-12-21)17(24)19-15-6-2-1-3-7-15/h1-8,13H,9-12H2,(H,19,24)