Vitas-M small molecule compound

3,3'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(5,6-dichloro-1-ethyl-2-methyl-1H-benzimidazol-3-ium)

Catalog ID
STL412481
SMILES CCn1c2cc(Cl)c(cc2[n+](c1C)CCOCCOCC[n+]1c2cc(Cl)c(cc2n(c1C)CC)Cl)Cl

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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 C26H32Cl4N4O2 MW 574.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32Cl4N4O2/c1-5-31-17(3)33(25-15-21(29)19(27)13-23(25)31)7-9-35-11-12-36-10-8-34-18(4)32(6-2)24-14-20(28)22(30)16-26(24)34/h13-16H,5-12H2,1-4H3/q+2
InChIKey
VAWRPKMAGPUKDL-UHFFFAOYSA-N
Synonyms

33((ethane12diylbis(oxy))bis(ethane21diyl))bis(56dichloro1ethyl2methyl1Hbenzo(d)imidazol3ium)iodide
33(ETHANE12DIYLBIS(OXYETHANE21DIYL))BIS(56DICHLORO1ETHYL2METHYL1H31BENZIMIDAZOL3IUM)
33(ethane12diylbis(oxyethane21diyl))bis(56dichloro1ethyl2methyl1Hbenzimidazol3ium)
56DICHLORO1(2(2(2(56DICHLORO3ETHYL2METHYLBENZIMIDAZOL1IUM1YL)ETHOXY)ETHOXY)ETHYL)3ETHYL2METHYLBENZIMIDAZOL1IUM
CCN1C(=(N+)(C2=CC(=C(C=C21)Cl)Cl)CCOCCOCC(N+)3=C(N(C4=CC(=C(C=C43)Cl)Cl)CC)C)C
CCn1c2cc(Cl)c(cc2(n+)(c1C)CCOCCOCC(n+)1c2cc(Cl)c(cc2n(c1C)CC)Cl)Cl
CCn1c2cc(Cl)c(cc2(n+)(c1C)CCOCCOCC(n+)1c2cc(Cl)c(cc2n(c1C)CC)Cl)Cl(I)(I)
InChI=1SC26H32Cl4N4O2c153117(3)33(251521(29)19(27)1323(25)31)79351112361083418(4)32(62)241420(28)22(30)1626(24)34h1316H512H214H3q+2
MFCD00643261
ZINC000001883948
ZINC01883948
ZINC1883948

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Available files

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