N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[3,5-bis(trifluoromethyl)anilino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[[3,5-bis(trifluoromethyl)phenyl]thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C18H14F6N2O3S MolecularWeight: 452.370779

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H14F6N2O3S/c1-28-12-4-3-5-13(29-2)14(12)15(27)26-16(30)25-11-7-9(17(19,20)21)6-10(8-11)18(22,23)24/h3-8H,1-2H3,(H2,25,26,27,30)