3-[(4-chlorophenyl)carbamothioylamino]propanoic acid

Systemtic Name: 3-[(4-chlorophenyl)carbamothioylamino]propanoic acid Openeye Name: 3-[(4-chlorophenyl)carbamothioylamino]propanoic acid CAS Name: 3-[[(4-chloroanilino)-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-[(4-chlorophenyl)carbamothioylamino]propanoic acid Traditional Name: 3-[(4-chlorophenyl)thiocarbamoylamino]propionic acid Formula: C10H11ClN2O2S MolecularWeight: 258.72454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)NCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=S)NCCC(=O)O)Cl

InChI

InChI=1S/C10H11ClN2O2S/c11-7-1-3-8(4-2-7)13-10(16)12-6-5-9(14)15/h1-4H,5-6H2,(H,14,15)(H2,12,13,16)