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ARRY-380 (analog)-[d3]

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General Information
Catalog: BLP-013775
CAS: 1795011-57-2
Molecular Formula: C29H24D3N7O4S
Molecular Weight: 572.65

Chemical Structure

Description	ARRY-380 (analog)-[d3] is the labelled analogue of ARRY-380 (analog), which is an analog of ARRY-380. ARRY-380 is an orally bioavailable inhibitor of the human epidermal growth factor receptor tyrosine kinase ErbB-2.
Synonyms	ARRY-380 (analog)-d3; 6-[5-[[[2-(Methyl-d3-sulfonyl)ethyl]amino]methyl]-2-furanyl]-N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]-4-quinazolinamine
IUPAC Name	N-[3-methyl-4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)phenyl]-6-[5-[[2-(trideuteriomethylsulfonyl)ethylamino]methyl]furan-2-yl]quinazolin-4-amine
Related CAS	937265-83-3 (unlabelled)
Canonical SMILES	CC1=C(C=CC(=C1)NC2=NC=NC3=C2C=C(C=C3)C4=CC=C(O4)CNCCS(=O)(=O)C)OC5=CC6=NC=NN6C=C5
InChI	InChI=1S/C29H27N7O4S/c1-19-13-21(4-7-26(19)39-22-9-11-36-28(15-22)32-18-34-36)35-29-24-14-20(3-6-25(24)31-17-33-29)27-8-5-23(40-27)16-30-10-12-41(2,37)38/h3-9,11,13-15,17-18,30H,10,12,16H2,1-2H3,(H,31,33,35)/i2D3
InChI Key	QVMNYGOVNWWFKF-BMSJAHLVSA-N