Products 1684452-91-2

CAS 1684452-91-2 is the registry number for Mirabegron Impurity 59. Offered by: Chemat Brand. Available pack sizes: on request.

Mirabegron Impurity 59
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

[(1R)-2-[2-(4-aminophenyl)ethyl-[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-1-phenylethyl] 2-(2-amino-1,3-thiazol-4-yl)acetate (CAS 1684452-91-2) is a chemical compound with the molecular formula C26H28N6O3S2 and a molecular weight of 536.7 g/mol. IUPAC name: [(1R)-2-[2-(4-aminophenyl)ethyl-[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-1-phenylethyl] 2-(2-amino-1,3-thiazol-4-yl)acetate. InChIKey: BFQNWFOQWPLYSO-QFIPXVFZSA-N.

Identity
Molecular formulaC26H28N6O3S2
Molecular weight536.7 g/mol
IUPAC name[(1R)-2-[2-(4-aminophenyl)ethyl-[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-1-phenylethyl] 2-(2-amino-1,3-thiazol-4-yl)acetate
InChIKeyBFQNWFOQWPLYSO-QFIPXVFZSA-N
SMILESC1=CC=C(C=C1)[C@H](CN(CCC2=CC=C(C=C2)N)C(=O)CC3=CSC(=N3)N)OC(=O)CC4=CSC(=N4)N

Computed by PubChem (NCBI)

Isomers (same molecular formula)
2-(2-amino-1,3-thiazol-4-yl)-N-[4-[2-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]-[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]acetamide C26H28N6O3S2
2-(2-amino-1,3-thiazol-4-yl)-N-[4-[2-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]anilino]-2-oxoethyl]-1,3-thiazol-2-yl]acetamide C26H28N6O3S2