4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]benzoic acid

Systemtic Name: 4-[(4-ethoxyphenyl)carbonylcarbamothioylamino]benzoic acid Openeye Name: 4-[(4-ethoxybenzoyl)carbamothioylamino]benzoic acid CAS Name: 4-[[[[(4-ethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-[(4-ethoxybenzoyl)carbamothioylamino]benzoic acid Traditional Name: 4-[(4-ethoxybenzoyl)thiocarbamoylamino]benzoic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H16N2O4S/c1-2-23-14-9-5-11(6-10-14)15(20)19-17(24)18-13-7-3-12(4-8-13)16(21)22/h3-10H,2H2,1H3,(H,21,22)(H2,18,19,20,24)