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

Systemtic Name: 4-hexoxy-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide CAS Name: 4-hexoxy-N-[sulfanylidene-(2,4,5-trichloroanilino)methyl]benzamide IUPAC Name: 4-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 4-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=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C20H21Cl3N2O2S/c1-2-3-4-5-10-27-14-8-6-13(7-9-14)19(26)25-20(28)24-18-12-16(22)15(21)11-17(18)23/h6-9,11-12H,2-5,10H2,1H3,(H2,24,25,26,28)