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CATAPS859212161
CAS859212-16-1
Structure
SynonymsNS 187,N-[3-([4,5'-Bipyrimidin]-2-ylamino)-4-methylphenyl]-4-[[(3S)-3-(dimethylamino)-1-pyrrolidinyl]methyl]-3-(trifluoromethyl)benzamide, INNO 406
IUPAC Name4-[[(3S)-3-(dimethylamino)pyrrolidin-1-yl]methyl]-N-[4-methyl-3-[(4-pyrimidin-5-ylpyrimidin-2-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
Molecular Weight576.62
Molecular FormulaC30H31F3N8O
Canonical SMILESCN(C)[C@H]1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc3ccc(C)c(Nc4nccc(n4)c5cncnc5)c3)C1
InChIInChI=1S/C30H31F3N8O/c1-19-4-7-23(13-27(19)39-29-36-10-8-26(38-29)22-14-34-18-35-15-22)37-28(42)20-5-6-21(25(12-20)30(31,32)33)16-41-11-9-24(17-41)40(2)3/h4-8,10,12-15,18,24H,9,11,16-17H2,1-3H3,(H,37,42)(H,36,38,39)/t24-/m0/s1
Accurate Mass576.2573
FormatNeat
SubcategoryAbl kinase inhibitors, Chiral molecules, Enzyme inhibitors
  • Verification code
CATSizeShippingStorage Conditions
APS859212161-10MG 10MG Room Temperature 2-8°C Fridge/Coldroom Inquiry
APS859212161-5MG 5MG Room Temperature 2-8°C Fridge/Coldroom Inquiry
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