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

Systemtic Name: 3-bromanyl-4-hexoxy-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-hexoxy-N-[sulfanylidene-(2,4,5-trichloroanilino)methyl]benzamide IUPAC Name: 3-bromo-4-hexoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-hexoxy-N-[(2,4,5-trichlorophenyl)thiocarbamoyl]benzamide Formula: C20H20BrCl3N2O2S MolecularWeight: 538.713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20BrCl3N2O2S/c1-2-3-4-5-8-28-18-7-6-12(9-13(18)21)19(27)26-20(29)25-17-11-15(23)14(22)10-16(17)24/h6-7,9-11H,2-5,8H2,1H3,(H2,25,26,27,29)