Benthiavalicarb

The active substance and compound Benthiavalicarb, term code RF-0043-002-PPP of the EFSA Harmonized terminology for scientific research, also referred to as '[(2S)-1-{[(1R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl]amino}-3-methyl-1-oxobutan-2-yl]carbamic acid, N-[(1S)-1-[[[(1R)-1-(6-fluoro-2-benzothiazolyl)ethyl]amino]carbonyl]-2-methylpropyl]carbamic acid'. IDENTIFIERS: IUPAC name: [(1S)-1-{[(1R)-1-(6-fluoro-1,3-benzothiazol-2-yl)ethyl]carbamoyl}-2-methylpropyl]carbamic acid. Chemical Abstracts Service (CAS) number: 413615-35-7. Simplified molecular-input line-entry system (SMILES) notation: CC(C)C@HC(=O)NC@Hc1nc2ccc(F)cc2s1. International Chemical Identifier (InChITM): InChI=1S/C15H18FN3O3S/c1-7(2)12(19-15(21)22)13(20)17-8(3)14-18-10-5-4-9(16)6-11(10)23-14/h4-8,12,19H,1-3H3,(H,17,20)(H,21,22)/t8-,12+/m1/s1.