N-[3-(trifluoromethyl)phenyl]azepane-1-carbothioamide

Systemtic Name: N-[3-(trifluoromethyl)phenyl]azepane-1-carbothioamide Openeye Name: N-[3-(trifluoromethyl)phenyl]azepane-1-carbothioamide CAS Name: N-[3-(trifluoromethyl)phenyl]-1-azepanecarbothioamide IUPAC Name: N-[3-(trifluoromethyl)phenyl]azepane-1-carbothioamide Traditional Name: N-[3-(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(=C2)C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C14H17F3N2S/c15-14(16,17)11-6-5-7-12(10-11)18-13(20)19-8-3-1-2-4-9-19/h5-7,10H,1-4,8-9H2,(H,18,20)