Vitas-M small molecule compound
3,3'-propane-1,3-diylbis(5-chloro-1-ethyl-2-methyl-1H-3,1-benzimidazol-3-ium)
Catalog ID
STK050595
SMILES CCn1c2ccc(cc2[n+](c1C)CCC[n+]1c2cc(Cl)ccc2n(c1C)CC)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 C23H28Cl2N4 MW 431.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28Cl2N4/c1-5-26-16(3)28(22-14-18(24)8-10-20(22)26)12-7-13-29-17(4)27(6-2)21-11-9-19(25)15-23(21)29/h8-11,14-15H,5-7,12-13H2,1-4H3/q+2InChIKey
CWFICATYHXALHQ-UHFFFAOYSA-NSynonyms
33PROPANE13DIYLBIS(5CHLORO1ETHYL2METHYL1H31BENZIMIDAZOL3IUM)
5CHLORO3(3(5CHLORO1ETHYL2METHYLBENZIMIDAZOL3YL)PROPYL)1ETHYL2METHYLBENZIMIDAZOLE
5CHLORO3(3(6CHLORO3ETHYL2METHYLBENZIMIDAZOL3IUM1YL)PROPYL)1ETHYL2METHYLBENZIMIDAZOL1IUM
CC(N+)1=C(N(C2=C1C=CC(=C2)Cl)CCCN3C(=(N+)(C4=C3C=C(C=C4)Cl)CC)C)C
CCn1c2ccc(cc2(n+)(c1C)CCC(n+)1c2cc(Cl)ccc2n(c1C)CC)Cl
InChI=1SC23H28Cl2N4c152616(3)28(221418(24)81020(22)26)127132917(4)27(62)2111919(25)1523(21)29h8111415H571213H214H3q+2
MFCD00643258
STK050595
ZINC000000827773
ZINC00827773
ZINC827773
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