4-[3-(hydroxymethyl)piperidin-1-yl]-2-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: 4-[3-(hydroxymethyl)piperidin-1-yl]-2-(trifluoromethyl)benzenecarbothioamide Openeye Name: 4-[3-(hydroxymethyl)-1-piperidyl]-2-(trifluoromethyl)benzenecarbothioamide CAS Name: 4-[3-(hydroxymethyl)-1-piperidinyl]-2-(trifluoromethyl)benzenecarbothioamide IUPAC Name: 4-[3-(hydroxymethyl)piperidin-1-yl]-2-(trifluoromethyl)benzenecarbothioamide Traditional Name: 4-(3-methylolpiperidino)-2-(trifluoromethyl)thiobenzamide Formula: C14H17F3N2OS MolecularWeight: 318.35779

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC(=C(C=C2)C(=S)N)C(F)(F)F)CO

Isomeric SMILES

C1CC(CN(C1)C2=CC(=C(C=C2)C(=S)N)C(F)(F)F)CO

InChI

InChI=1S/C14H17F3N2OS/c15-14(16,17)12-6-10(3-4-11(12)13(18)21)19-5-1-2-9(7-19)8-20/h3-4,6,9,20H,1-2,5,7-8H2,(H2,18,21)