2-[(3-chlorophenyl)carbamothioylamino]ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)carbamothioylamino]ethanoic acid Openeye Name: 2-[(3-chlorophenyl)carbamothioylamino]acetic acid CAS Name: 2-[[(3-chloroanilino)-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[(3-chlorophenyl)carbamothioylamino]acetic acid Traditional Name: 2-[(3-chlorophenyl)thiocarbamoylamino]acetic acid Formula: C9H9ClN2O2S MolecularWeight: 244.69796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)NCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)NCC(=O)O

InChI

InChI=1S/C9H9ClN2O2S/c10-6-2-1-3-7(4-6)12-9(15)11-5-8(13)14/h1-4H,5H2,(H,13,14)(H2,11,12,15)