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

Systemtic Name: 3-bromanyl-4-butoxy-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[sulfanylidene-(2,4,5-trichloroanilino)methyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(2,4,5-trichlorophenyl)thiocarbamoyl]benzamide Formula: C18H16BrCl3N2O2S MolecularWeight: 510.65984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2Cl)Cl)Cl)Br

InChI

InChI=1S/C18H16BrCl3N2O2S/c1-2-3-6-26-16-5-4-10(7-11(16)19)17(25)24-18(27)23-15-9-13(21)12(20)8-14(15)22/h4-5,7-9H,2-3,6H2,1H3,(H2,23,24,25,27)