Vitas-M small molecule compound
5-(ethoxycarbonyl)-1,3-diethyl-2-[(E)-2-(phenylamino)ethenyl]-1H-3,1-benzimidazol-3-ium
Catalog ID
STK396283
SMILES CCOC(=O)c1ccc2c(c1)[n+](CC)c(n2CC)/C=C/Nc1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H26N3O2 MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2/c1-4-24-19-13-12-17(22(26)27-6-3)16-20(19)25(5-2)21(24)14-15-23-18-10-8-7-9-11-18/h7-16H,4-6H2,1-3H3/p+1InChIKey
LNCXUZHUVRPLPZ-UHFFFAOYSA-OSynonyms
5(ethoxycarbonyl)13diethyl2((E)2(phenylamino)ethenyl)1H31benzimidazol3ium
6ETHOXYCARBONYL13DIETHYL2(2PHENYLAMINOVINYL)3HBENZOIMIDAZOL1IUM
CCN1C2=C(C=CC(=C2)C(=O)OCC)(N+)(=C1C=CNC3=CC=CC=C3)CC
CCOC(=O)c1ccc2c(c1)(n+)(CC)c(n2CC)C=CNc1ccccc1
ETHYL2((1E)2(PHENYLAMINO)VINYL)13DIETHYLBENZIMIDAZOLE5CARBOXYLATE
ETHYL2((E)2ANILINOETHENYL)13DIETHYLBENZIMIDAZOL1IUM5CARBOXYLATE
ETHYL2(2ANILINOETHENYL)13DIETHYLBENZIMIDAZOL1IUM5CARBOXYLATE
InChI=1SC22H25N3O2c142419131217(22(26)2763)1620(19)25(52)21(24)14152318108791118h716H46H213H3p+1
MFCD00602801
ZINC000254733889
ZINC000254733890
ZINC100494433
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