Vitas-M small molecule compound
5-chloro-1,3-diethyl-2-methyl-1H-3,1-benzimidazol-3-ium
Catalog ID
STK396337
SMILES CCn1c(C)[n+](c2c1ccc(c2)Cl)CC
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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 C12H16ClN2 MW 223.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClN2/c1-4-14-9(3)15(5-2)12-8-10(13)6-7-11(12)14/h6-8H,4-5H2,1-3H3/q+1InChIKey
UBKZAPKYLGYPAO-UHFFFAOYSA-NSynonyms
5chloro13diethyl2methyl1H31benzimidazol3ium
5CHLORO13DIETHYL2METHYLBENZIMIDAZOL1IUM
6CHLORO13DIETHYL2METHYL3HBENZOIMIDAZOL1IUM
CCN1C(=(N+)(C2=C1C=C(C=C2)Cl)CC)C
CCn1c(C)(n+)(c2c1ccc(c2)Cl)CC
InChI=1SC12H16ClN2c14149(3)15(52)12810(13)6711(12)14h68H45H213H3q+1
MFCD00602378
ZINC000012341519
ZINC12341519
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