4-methoxy-N-phenyl-3-[[4-(trifluoromethyl)phenyl]carbamothioylamino]benzamide

Systemtic Name: 4-methoxy-N-phenyl-3-[[4-(trifluoromethyl)phenyl]carbamothioylamino]benzamide Openeye Name: 4-methoxy-N-phenyl-3-[[4-(trifluoromethyl)phenyl]carbamothioylamino]benzamide CAS Name: 4-methoxy-N-phenyl-3-[[sulfanylidene-[4-(trifluoromethyl)anilino]methyl]amino]benzamide IUPAC Name: 4-methoxy-N-phenyl-3-[[4-(trifluoromethyl)phenyl]carbamothioylamino]benzamide Traditional Name: 4-methoxy-N-phenyl-3-[[4-(trifluoromethyl)phenyl]thiocarbamoylamino]benzamide Formula: C22H18F3N3O2S MolecularWeight: 445.45743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)NC(=S)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H18F3N3O2S/c1-30-19-12-7-14(20(29)26-16-5-3-2-4-6-16)13-18(19)28-21(31)27-17-10-8-15(9-11-17)22(23,24)25/h2-13H,1H3,(H,26,29)(H2,27,28,31)