N-[4-chloranyl-2-(trifluoromethyl)phenyl]azocane-1-carbothioamide

Systemtic Name: N-[4-chloranyl-2-(trifluoromethyl)phenyl]azocane-1-carbothioamide Openeye Name: N-[4-chloro-2-(trifluoromethyl)phenyl]azocane-1-carbothioamide CAS Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-1-azocanecarbothioamide IUPAC Name: N-[4-chloro-2-(trifluoromethyl)phenyl]azocane-1-carbothioamide Traditional Name: N-[4-chloro-2-(trifluoromethyl)phenyl]azocane-1-carbothioamide Formula: C15H18ClF3N2S MolecularWeight: 350.83003

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=S)NC2=C(C=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

C1CCCN(CCC1)C(=S)NC2=C(C=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C15H18ClF3N2S/c16-11-6-7-13(12(10-11)15(17,18)19)20-14(22)21-8-4-2-1-3-5-9-21/h6-7,10H,1-5,8-9H2,(H,20,22)