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(Q83037764)
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English
N-(2-(((2-(Dimethylamino)ethyl)amino)carbonyl)-1-methyl-1H-imidazol-4-yl)-1-methyl-4-((1-oxo-4-(4-pyrenyl)butyl)amino)-1H-imidazole-2-carboxamide
chemical compound
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
604.2910370120003
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₃₄H₃₆N₈O₃
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canonical SMILES
CN1C=C(N=C1C(=O)NC2=CN(C(=N2)C(=O)NCCN(C)C)C)NC(=O)CCCC3=CC4=CC=CC5=C4C6=C(C=CC=C36)C=C5
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Identifiers
InChI
InChI=1S/C34H36N8O3/c1-40(2)17-16-35-33(44)31-38-27(20-41(31)3)39-34(45)32-37-26(19-42(32)4)36-28(43)13-7-10-23-18-24-11-5-8-21-14-15-22-9-6-12-25(23)30(22)29(21)24/h5-6,8-9,11-12,14-15,18-20H,7,10,13,16-17H2,1-4H3,(H,35,44)(H,36,43)(H,39,45)
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InChIKey
NSRZPOSMIQUCDJ-UHFFFAOYSA-N
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CAS Registry Number
166982-64-5
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PubChem CID
3025903
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matched by identifier from
InChIKey
InChIKey
NSRZPOSMIQUCDJ-UHFFFAOYSA-N
UniChem compound ID
56033540
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60168216
1 reference
matched by identifier from
InChIKey
InChIKey
NSRZPOSMIQUCDJ-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID5090707
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