3-[carbamothioyl-(3-hydroxyphenyl)amino]propanoic acid

Systemtic Name: 3-[carbamothioyl-(3-hydroxyphenyl)amino]propanoic acid Openeye Name: 3-(N-carbamothioyl-3-hydroxy-anilino)propanoic acid CAS Name: 3-(N-carbamothioyl-3-hydroxyanilino)propanoic acid IUPAC Name: 3-(N-carbamothioyl-3-hydroxyanilino)propanoic acid Traditional Name: 3-(3-hydroxy-N-thiocarbamoyl-anilino)propionic acid Formula: C10H12N2O3S MolecularWeight: 240.27888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)N(CCC(=O)O)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)O)N(CCC(=O)O)C(=S)N

InChI

InChI=1S/C10H12N2O3S/c11-10(16)12(5-4-9(14)15)7-2-1-3-8(13)6-7/h1-3,6,13H,4-5H2,(H2,11,16)(H,14,15)