methyl 4-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]benzoate Openeye Name: methyl 4-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(4-ethylphenoxy)acetyl]thiocarbamoylamino]benzoic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H20N2O4S/c1-3-13-4-10-16(11-5-13)25-12-17(22)21-19(26)20-15-8-6-14(7-9-15)18(23)24-2/h4-11H,3,12H2,1-2H3,(H2,20,21,22,26)