Products 1425038-27-2

CAS 1425038-27-2 appears in our catalog under these names: Grazoprevir sodium salt, MK–5172 sodium salt, MK-5172 sodium salt. Offered by: TargetMol, GLPBio, Biosynth, MedChemExpress. Available pack sizes: 25mg, 50mg, 100mg, 10mg, 5mg, Get quote.

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

Sodium [(1R,2S)-1-[[(1R,18R,20R,24S,27S)-24-tert-butyl-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carbonyl]amino]-2-ethenylcyclopropanecarbonyl]-cyclopropylsulfonylazanide (CAS 1425038-27-2) is a chemical compound with the molecular formula C38H49N6NaO9S and a molecular weight of 788.9 g/mol. IUPAC name: sodium [(1R,2S)-1-[[(1R,18R,20R,24S,27S)-24-tert-butyl-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carbonyl]amino]-2-ethenylcyclopropanecarbonyl]-cyclopropylsulfonylazanide. InChIKey: HWKZBIVJZNPHGU-CIAYNJNFSA-M.

Identity
Molecular formulaC38H49N6NaO9S
Molecular weight788.9 g/mol
IUPAC namesodium [(1R,2S)-1-[[(1R,18R,20R,24S,27S)-24-tert-butyl-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carbonyl]amino]-2-ethenylcyclopropanecarbonyl]-cyclopropylsulfonylazanide
InChIKeyHWKZBIVJZNPHGU-CIAYNJNFSA-M
SMILESCC(C)(C)[C@H]1C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@]3(C[C@H]3C=C)C(=O)[N-]S(=O)(=O)C4CC4)OC5=NC6=C(C=CC(=C6)OC)N=C5CCCCC[C@@H]7C[C@H]7OC(=O)N1.[Na+]

Computed by PubChem (NCBI)