Vitas-M small molecule compound
1-(cyanomethyl)-3-ethyl-1H-3,1-benzimidazol-3-ium
Catalog ID
STK380660
SMILES N#CCn1c[n+](c2c1cccc2)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 C11H12N3 MW 186.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N3/c1-2-13-9-14(8-7-12)11-6-4-3-5-10(11)13/h3-6,9H,2,8H2,1H3/q+1InChIKey
YSHQUWQHPZXJMA-UHFFFAOYSA-NSynonyms
1(cyanomethyl)3ethyl1H31benzimidazol3ium
2(3ETHYLBENZIMIDAZOL1IUM1YL)ACETONITRILE
CCN1C=(N+)(C2=CC=CC=C21)CC#N
InChI=1SC11H12N3c1213914(8712)11643510(11)13h369H28H21H3q+1
MFCD02104931
N#CCn1c(n+)(c2c1cccc2)CC
ZINC000004083425
ZINC04083425
ZINC4083425
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