4-(phenylsulfonyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(phenylsulfonyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-[2-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-besyl-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C18H18F3N3O2S2 MolecularWeight: 429.47963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=S)NC2=CC=CC=C2C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H18F3N3O2S2/c19-18(20,21)15-8-4-5-9-16(15)22-17(27)23-10-12-24(13-11-23)28(25,26)14-6-2-1-3-7-14/h1-9H,10-13H2,(H,22,27)