2-hexoxy-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[sulfanylidene-(2,4,5-trichloroanilino)methyl]benzamide IUPAC Name: 2-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[(2,4,5-trichlorophenyl)thiocarbamoyl]benzamide Formula: C20H21Cl3N2O2S MolecularWeight: 459.81694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C20H21Cl3N2O2S/c1-2-3-4-7-10-27-18-9-6-5-8-13(18)19(26)25-20(28)24-17-12-15(22)14(21)11-16(17)23/h5-6,8-9,11-12H,2-4,7,10H2,1H3,(H2,24,25,26,28)