N-[[2-[[[4-[Imino[[[(3-methylpentyl)oxy]carbonyl]amino]methyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-beta-Alanine Ethyl Ester
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![N-[[2-[[[4-[Imino[[[(3-methylpentyl)oxy]carbonyl]amino]methyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-beta-Alanine Ethyl Ester](https://assets.lgcstandards.com/sys-master%2Fimages%2Fha4%2Fhe5%2F10620582199326%2FD222590.png)
- structure.search.product.name N-[[2-[[[4-[Imino[[[(3-methylpentyl)oxy]carbonyl]amino]methyl]phenyl]amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl]-N-2-pyridinyl-beta-Alanine Ethyl Ester
- Product Code: TRC-D222590
- CAS Number: 2225986-94-5
- Brand: TRC
Product Overview
Product Code
TRC-D222590
CAS Number
Product Format
Neat
Molecular Formula
C34 H41 N7 O5
Molecular Weight
627.733
Product Categories
Product Type
ImpurityDocumentation
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Product Information
Chemical Data
Analyte Name
N-((2-(((4-(Imino((((3-methylpentyl)oxy)carbonyl)amino)methyl)phenyl)amino)methyl)-1-methyl-1H-benzimidazol-5-yl)carbonyl)-N-2-pyridinyl-beta-Alanine Ethyl Ester
CAS Number
2225986-94-5
Molecular Formula
C34 H41 N7 O5
Molecular Weight
627.733
Accurate Mass
627.317
SMILES
CCOC(=O)CCN(C(=O)c1ccc2c(c1)nc(CNc3ccc(cc3)C(=N)NC(=O)OCCC(C)CC)n2C)c4ccccn4
InChI
InChI=1S/C34H41N7O5/c1-5-23(3)17-20-46-34(44)39-32(35)24-10-13-26(14-11-24)37-22-30-38-27-21-25(12-15-28(27)40(30)4)33(43)41(19-16-31(42)45-6-2)29-9-7-8-18-36-29/h7-15,18,21,23,37H,5-6,16-17,19-20,22H2,1-4H3,(H2,35,39,44)
IUPAC
ethyl 3-[[1-methyl-2-[[4-[N-(3-methylpentoxycarbonyl)carbamimidoyl]anilino]methyl]benzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
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