N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide

Systemtic Name: N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide Openeye Name: N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide CAS Name: N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide IUPAC Name: N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide Traditional Name: N-(3-fluorophenyl)-2-[2-methyl-4-(trifluoromethyl)phenyl]-5-propyl-1,3-thiazinane-3-carbothioamide Formula: C22H24F4N2S2 MolecularWeight: 456.562973

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CN(C(SC1)C2=C(C=C(C=C2)C(F)(F)F)C)C(=S)NC3=CC(=CC=C3)F

Isomeric SMILES

CCCC1CN(C(SC1)C2=C(C=C(C=C2)C(F)(F)F)C)C(=S)NC3=CC(=CC=C3)F

InChI

InChI=1S/C22H24F4N2S2/c1-3-5-15-12-28(21(29)27-18-7-4-6-17(23)11-18)20(30-13-15)19-9-8-16(10-14(19)2)22(24,25)26/h4,6-11,15,20H,3,5,12-13H2,1-2H3,(H,27,29)