Products 1187586-58-8

CAS 1187586-58-8 appears in our catalog under these names: Montelukast EP Impurity E(R,S-Isomer), Montelukast EP Impurity E;USP Montelukast Related Compound D, Montelukast EP Impurity E , Montelukast Impurity 5(EP Impurity E), (R,S)-Montelukast Bis-sulfide. Offered by: Chemat Brand, Hubei YoungXin, TRC, Mikromol, GLPBio. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 5mg.

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

2-[1-[[(1R)-1-[3-[(1S)-1-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-2-(7-chloroquinolin-2-yl)ethyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid (CAS 1187586-58-8) is a chemical compound with the molecular formula C41H46ClNO5S2 and a molecular weight of 732.4 g/mol. IUPAC name: 2-[1-[[(1R)-1-[3-[(1S)-1-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-2-(7-chloroquinolin-2-yl)ethyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid. InChIKey: SJNODSMYYCYZTO-XDSPJLLDSA-N.

Identity
Molecular formulaC41H46ClNO5S2
Molecular weight732.4 g/mol
IUPAC name2-[1-[[(1R)-1-[3-[(1S)-1-[[1-(carboxymethyl)cyclopropyl]methylsulfanyl]-2-(7-chloroquinolin-2-yl)ethyl]phenyl]-3-[2-(2-hydroxypropan-2-yl)phenyl]propyl]sulfanylmethyl]cyclopropyl]acetic acid
InChIKeySJNODSMYYCYZTO-XDSPJLLDSA-N
SMILESCC(C)(C1=CC=CC=C1CC[C@H](C2=CC(=CC=C2)[C@H](CC3=NC4=C(C=CC(=C4)Cl)C=C3)SCC5(CC5)CC(=O)O)SCC6(CC6)CC(=O)O)O

Computed by PubChem (NCBI)