2-chloranyl-4-[2-(4-chlorophenyl)sulfanylethanoylcarbamothioylamino]benzoate

Systemtic Name: 2-chloranyl-4-[2-(4-chlorophenyl)sulfanylethanoylcarbamothioylamino]benzoate Openeye Name: 2-chloro-4-[[2-(4-chlorophenyl)sulfanylacetyl]carbamothioylamino]benzoate CAS Name: 2-chloro-4-[[[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 2-chloro-4-[[2-(4-chlorophenyl)sulfanylacetyl]carbamothioylamino]benzoate Traditional Name: 2-chloro-4-[[2-[(4-chlorophenyl)thio]acetyl]thiocarbamoylamino]benzoate Formula: C16H11Cl2N2O3S2- MolecularWeight: 414.30614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC(=O)NC(=S)NC2=CC(=C(C=C2)C(=O)[O-])Cl)Cl

InChI

InChI=1S/C16H12Cl2N2O3S2/c17-9-1-4-11(5-2-9)25-8-14(21)20-16(24)19-10-3-6-12(15(22)23)13(18)7-10/h1-7H,8H2,(H,22,23)(H2,19,20,21,24)/p-1