3-[(4-ethoxyphenyl)carbamothioylamino]benzoic acid

Systemtic Name: 3-[(4-ethoxyphenyl)carbamothioylamino]benzoic acid Openeye Name: 3-[(4-ethoxyphenyl)carbamothioylamino]benzoic acid CAS Name: 3-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3-[(4-ethoxyphenyl)carbamothioylamino]benzoic acid Traditional Name: 3-(p-phenetylthiocarbamoylamino)benzoic acid Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/c1-2-21-14-8-6-12(7-9-14)17-16(22)18-13-5-3-4-11(10-13)15(19)20/h3-10H,2H2,1H3,(H,19,20)(H2,17,18,22)