1-[2,3,4-tris(fluoranyl)phenyl]carbonylpiperidine-4-carbothioamide

Systemtic Name: 1-[2,3,4-tris(fluoranyl)phenyl]carbonylpiperidine-4-carbothioamide Openeye Name: 1-(2,3,4-trifluorobenzoyl)piperidine-4-carbothioamide CAS Name: 1-[oxo-(2,3,4-trifluorophenyl)methyl]-4-piperidinecarbothioamide IUPAC Name: 1-(2,3,4-trifluorobenzoyl)piperidine-4-carbothioamide Traditional Name: 1-(2,3,4-trifluorobenzoyl)thioisonipecotamide Formula: C13H13F3N2OS MolecularWeight: 302.31533

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=S)N)C(=O)C2=C(C(=C(C=C2)F)F)F

Isomeric SMILES

C1CN(CCC1C(=S)N)C(=O)C2=C(C(=C(C=C2)F)F)F

InChI

InChI=1S/C13H13F3N2OS/c14-9-2-1-8(10(15)11(9)16)13(19)18-5-3-7(4-6-18)12(17)20/h1-2,7H,3-6H2,(H2,17,20)