Products 1858276-04-6

CAS 1858276-04-6 appears in our catalog under these names: Tak-981, 95%, TAK-981, Subasumstat/ 98.22% (existing batch purity), Subasumstat, Subasumstat 98%. Offered by: Combi-blocks, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: 250mg, 100mg, 25mg, 1mg, 2mg, 5mg, 10mg, 50mg.

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

[(1R,2S,4R)-4-[[5-[4-[(1R)-7-chloro-1,2,3,4-tetrahydroisoquinolin-1-yl]-5-methylthiophene-2-carbonyl]pyrimidin-4-yl]amino]-2-hydroxycyclopentyl]methyl sulfamate (CAS 1858276-04-6) is a chemical compound with the molecular formula C25H28ClN5O5S2 and a molecular weight of 578.1 g/mol. IUPAC name: [(1R,2S,4R)-4-[[5-[4-[(1R)-7-chloro-1,2,3,4-tetrahydroisoquinolin-1-yl]-5-methylthiophene-2-carbonyl]pyrimidin-4-yl]amino]-2-hydroxycyclopentyl]methyl sulfamate. InChIKey: LXRZVMYMQHNYJB-UNXOBOICSA-N.

Identity
Molecular formulaC25H28ClN5O5S2
Molecular weight578.1 g/mol
IUPAC name[(1R,2S,4R)-4-[[5-[4-[(1R)-7-chloro-1,2,3,4-tetrahydroisoquinolin-1-yl]-5-methylthiophene-2-carbonyl]pyrimidin-4-yl]amino]-2-hydroxycyclopentyl]methyl sulfamate
InChIKeyLXRZVMYMQHNYJB-UNXOBOICSA-N
SMILESCC1=C(C=C(S1)C(=O)C2=CN=CN=C2N[C@@H]3C[C@@H]([C@H](C3)O)COS(=O)(=O)N)[C@H]4C5=C(CCN4)C=CC(=C5)Cl

Computed by PubChem (NCBI)