2-[phenyl-(phenylmethylsulfanyl)carbothioyl-amino]ethanoic acid

Systemtic Name: 2-[phenyl-(phenylmethylsulfanyl)carbothioyl-amino]ethanoic acid Openeye Name: 2-(N-benzylsulfanylcarbothioylanilino)acetic acid CAS Name: 2-(N-[(phenylmethylthio)-sulfanylidenemethyl]anilino)acetic acid IUPAC Name: 2-(N-benzylsulfanylcarbothioylanilino)acetic acid Traditional Name: 2-(N-(benzylthio)carbothioylanilino)acetic acid Formula: C16H15NO2S2 MolecularWeight: 317.4258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=S)N(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CSC(=S)N(CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H15NO2S2/c18-15(19)11-17(14-9-5-2-6-10-14)16(20)21-12-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,18,19)