N-(4-chloranyl-3-fluoranyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide

Systemtic Name: N-(4-chloranyl-3-fluoranyl-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Openeye Name: N-(4-chloro-3-fluoro-phenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide CAS Name: N-(4-chloro-3-fluorophenyl)-3-(hydroxymethyl)-1-piperidinecarbothioamide IUPAC Name: N-(4-chloro-3-fluorophenyl)-3-(hydroxymethyl)piperidine-1-carbothioamide Traditional Name: N-(4-chloro-3-fluoro-phenyl)-3-methylol-piperidine-1-carbothioamide Formula: C13H16ClFN2OS MolecularWeight: 302.795343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=S)NC2=CC(=C(C=C2)Cl)F)CO

Isomeric SMILES

C1CC(CN(C1)C(=S)NC2=CC(=C(C=C2)Cl)F)CO

InChI

InChI=1S/C13H16ClFN2OS/c14-11-4-3-10(6-12(11)15)16-13(19)17-5-1-2-9(7-17)8-18/h3-4,6,9,18H,1-2,5,7-8H2,(H,16,19)