2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide

Systemtic Name: 2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide Openeye Name: 2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide CAS Name: 2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide IUPAC Name: 2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide Traditional Name: 2-(3-chlorophenyl)-N-[3-(trifluoromethyl)phenyl]-1,3-thiazinane-3-carbothioamide Formula: C18H16ClF3N2S2 MolecularWeight: 416.91125

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(SC1)C2=CC(=CC=C2)Cl)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(C(SC1)C2=CC(=CC=C2)Cl)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H16ClF3N2S2/c19-14-6-1-4-12(10-14)16-24(8-3-9-26-16)17(25)23-15-7-2-5-13(11-15)18(20,21)22/h1-2,4-7,10-11,16H,3,8-9H2,(H,23,25)