N-[3-([5,5'-Bipyrimidin]-2-ylamino)-4-methylphenyl]-4-[[(3s)-3-(dimethylamino)-1-pyrrolidinyl]methyl]-3-(trifluoromethyl)benzamide, 98%, 98%

cas: 887650-05-7 — see every product listed under this CAS number, including other names

N-[3-([5,5'-Bipyrimidin]-2-ylamino)-4-methylphenyl]-4-[[(3s)-3-(dimethylamino)-1-pyrrolidinyl]methyl]-3-(trifluoromethyl)benzamide, 98%, 98% (CAS 887650-05-7) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 5mg, 10mg. Offered by: Chemat.

• 2D
• 3D

4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-[4-methyl-3-[(5-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide (CAS 887650-05-7) is a chemical compound with the molecular formula C30H31F3N8O and a molecular weight of 576.6 g/mol. IUPAC name: 4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-[4-methyl-3-[(5-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide. InChIKey: ZOPBZHLJXQAQON-VWLOTQADSA-N.

Identity

Molecular formula	C30H31F3N8O
Molecular weight	576.6 g/mol
IUPAC name	4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-[4-methyl-3-[(5-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
InChIKey	ZOPBZHLJXQAQON-VWLOTQADSA-N
SMILES	CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)CN3CC[C@@H](C3)N(C)C)C(F)(F)F)NC4=NC=C(C=N4)C5=CN=CN=C5

Computed by PubChem (NCBI)

Synonyms: Lyn-IN-1, isomer of bafetinib, orb1309458, ZOPBZHLJXQAQON-VWLOTQADSA-N, Lyn-IN-1 (Synonyms: Bafetinib analog)?

Isomers (same molecular formula)

4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide C₃₀H₃₁F₃N₈O