4-(4-bromophenyl)-4-oxidanyl-N-[3-(trifluoromethylsulfanyl)phenyl]piperidine-1-carbothioamide

Systemtic Name: 4-(4-bromophenyl)-4-oxidanyl-N-[3-(trifluoromethylsulfanyl)phenyl]piperidine-1-carbothioamide Openeye Name: 4-(4-bromophenyl)-4-hydroxy-N-[3-(trifluoromethylsulfanyl)phenyl]piperidine-1-carbothioamide CAS Name: 4-(4-bromophenyl)-4-hydroxy-N-[3-(trifluoromethylthio)phenyl]-1-piperidinecarbothioamide IUPAC Name: 4-(4-bromophenyl)-4-hydroxy-N-[3-(trifluoromethylsulfanyl)phenyl]piperidine-1-carbothioamide Traditional Name: 4-(4-bromophenyl)-4-hydroxy-N-[3-(trifluoromethylthio)phenyl]piperidine-1-carbothioamide Formula: C19H18BrF3N2OS2 MolecularWeight: 491.38823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)C(=S)NC3=CC(=CC=C3)SC(F)(F)F

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)C(=S)NC3=CC(=CC=C3)SC(F)(F)F

InChI

InChI=1S/C19H18BrF3N2OS2/c20-14-6-4-13(5-7-14)18(26)8-10-25(11-9-18)17(27)24-15-2-1-3-16(12-15)28-19(21,22)23/h1-7,12,26H,8-11H2,(H,24,27)