butyl 4-[2-[3,4-bis(chloranyl)phenoxy]ethanoylcarbamothioylamino]benzoate

Systemtic Name: butyl 4-[2-[3,4-bis(chloranyl)phenoxy]ethanoylcarbamothioylamino]benzoate Openeye Name: butyl 4-[[2-(3,4-dichlorophenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(3,4-dichlorophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(3,4-dichlorophenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(3,4-dichlorophenoxy)acetyl]thiocarbamoylamino]benzoic acid butyl ester Formula: C20H20Cl2N2O4S MolecularWeight: 455.3548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H20Cl2N2O4S/c1-2-3-10-27-19(26)13-4-6-14(7-5-13)23-20(29)24-18(25)12-28-15-8-9-16(21)17(22)11-15/h4-9,11H,2-3,10,12H2,1H3,(H2,23,24,25,29)