3-[2-(4-methoxyphenoxy)ethanoylcarbamothioylamino]benzoic acid

Systemtic Name: 3-[2-(4-methoxyphenoxy)ethanoylcarbamothioylamino]benzoic acid Openeye Name: 3-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]benzoic acid CAS Name: 3-[[[[2-(4-methoxyphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]benzoic acid Traditional Name: 3-[[2-(4-methoxyphenoxy)acetyl]thiocarbamoylamino]benzoic acid Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C17H16N2O5S/c1-23-13-5-7-14(8-6-13)24-10-15(20)19-17(25)18-12-4-2-3-11(9-12)16(21)22/h2-9H,10H2,1H3,(H,21,22)(H2,18,19,20,25)