N-[2-(trifluoromethyl)phenyl]azepane-1-carbothioamide

Systemtic Name: N-[2-(trifluoromethyl)phenyl]azepane-1-carbothioamide Openeye Name: N-[2-(trifluoromethyl)phenyl]azepane-1-carbothioamide CAS Name: N-[2-(trifluoromethyl)phenyl]-1-azepanecarbothioamide IUPAC Name: N-[2-(trifluoromethyl)phenyl]azepane-1-carbothioamide Traditional Name: N-[2-(trifluoromethyl)phenyl]azepane-1-carbothioamide Formula: C14H17F3N2S MolecularWeight: 302.35839

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C14H17F3N2S/c15-14(16,17)11-7-3-4-8-12(11)18-13(20)19-9-5-1-2-6-10-19/h3-4,7-8H,1-2,5-6,9-10H2,(H,18,20)