2-chloranyl-5-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]benzoate

Systemtic Name: 2-chloranyl-5-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]benzoate Openeye Name: 2-chloro-5-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 2-chloro-5-[[[[2-(4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoate IUPAC Name: 2-chloro-5-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 2-chloro-5-[[2-(4-ethylphenoxy)acetyl]thiocarbamoylamino]benzoate Formula: C18H16ClN2O4S- MolecularWeight: 391.84864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC(=C(C=C2)Cl)C(=O)[O-]

InChI

InChI=1S/C18H17ClN2O4S/c1-2-11-3-6-13(7-4-11)25-10-16(22)21-18(26)20-12-5-8-15(19)14(9-12)17(23)24/h3-9H,2,10H2,1H3,(H,23,24)(H2,20,21,22,26)/p-1