2-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[(4-ethoxycarbonylanilino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(4-ethoxycarbonylphenyl)carbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(4-carbethoxyphenyl)thiocarbamoylamino]phenyl]acetic acid Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O4S/c1-2-24-17(23)13-5-9-15(10-6-13)20-18(25)19-14-7-3-12(4-8-14)11-16(21)22/h3-10H,2,11H2,1H3,(H,21,22)(H2,19,20,25)