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

Systemtic Name: ethyl 4-[2-(4-ethylphenoxy)ethanoylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(4-ethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-ethylphenoxy)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(4-ethylphenoxy)acetyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S/c1-3-14-5-11-17(12-6-14)26-13-18(23)22-20(27)21-16-9-7-15(8-10-16)19(24)25-4-2/h5-12H,3-4,13H2,1-2H3,(H2,21,22,23,27)