Products 1799974-70-1

CAS 1799974-70-1 appears in our catalog under these names: KI696, KI696/ 98.42% (existing batch purity), KI696 99%, KI-696, 99%, 99%, KI696, 99.26%. Offered by: GLPBio, TargetMol, Biosynth, Ambeed, Chemat. Available pack sizes: 1mg, 5mg, 10mg, 25mg, 50mg, 100mg, 10mM (in 1ml dmso), 250mg.

Structural formula: {0} (CAS {1})

(3S)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid (CAS 1799974-70-1) is a chemical compound with the molecular formula C28H30N4O6S and a molecular weight of 550.6 g/mol. IUPAC name: (3S)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid. InChIKey: ZDNGJXBUEQNFBQ-GCJKJVERSA-N.

Identity
Molecular formulaC28H30N4O6S
Molecular weight550.6 g/mol
IUPAC name(3S)-3-(7-methoxy-1-methylbenzotriazol-5-yl)-3-[4-methyl-3-[[(4R)-4-methyl-1,1-dioxo-3,4-dihydro-5,1lambda6,2-benzoxathiazepin-2-yl]methyl]phenyl]propanoic acid
InChIKeyZDNGJXBUEQNFBQ-GCJKJVERSA-N
SMILESC[C@@H]1CN(S(=O)(=O)C2=CC=CC=C2O1)CC3=C(C=CC(=C3)[C@H](CC(=O)O)C4=CC5=C(C(=C4)OC)N(N=N5)C)C

Computed by PubChem (NCBI)

Synonyms: orb1709336, orb2901809