2-[4-(2-methoxyethylcarbamothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-methoxyethylcarbamothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(2-methoxyethylcarbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[(2-methoxyethylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(2-methoxyethylcarbamothioylamino)phenyl]acetic acid Traditional Name: 2-[4-(2-methoxyethylthiocarbamoylamino)phenyl]acetic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=S)NC1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

COCCNC(=S)NC1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C12H16N2O3S/c1-17-7-6-13-12(18)14-10-4-2-9(3-5-10)8-11(15)16/h2-5H,6-8H2,1H3,(H,15,16)(H2,13,14,18)