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Irbesartan-[d7]

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General Information
Catalog: BLP-005843
CAS: 1329496-43-6
Molecular Formula: C27H22D7F3N6O3
Molecular Weight: 435.57

Chemical Structure

Description	Irbesartan-[d7] is an isotopically labelled analogue of Irbesartan. Irbesartan is an antagonist of the angiotensin II type 1 (AT1) receptor. It is an insurmountable antagonist of AT1, as its antagonism cannot be overcome by increasing concentrations of angiotensin II.
Synonyms	2-butyl-3-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one-d7; Irbesartan D7; BMS-186295-d7; SR-47436-d7
IUPAC Name	2-(2,2,3,3,4,4,4-heptadeuteriobutyl)-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one
Related CAS	138402-11-6 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])CC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
Canonical SMILES	CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5
InChI	InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)/i1D3,2D2,3D2
InChI Key	YOSHYTLCDANDAN-NCKGIQLSSA-N
Purity	98% by CP