Vitas-M small molecule compound
1-(cyanomethyl)-3-(3,4-dichlorophenyl)-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL054485
SMILES N#CCn1cc([n+]2c1CCC2)c1ccc(c(c1)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 C14H12Cl2N3 MW 293.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12Cl2N3/c15-11-4-3-10(8-12(11)16)13-9-18(7-5-17)14-2-1-6-19(13)14/h3-4,8-9H,1-2,6-7H2/q+1InChIKey
GUENKXGASLZAJW-UHFFFAOYSA-NSynonyms
1(cyanomethyl)3(34dichlorophenyl)1567tetrahydropyrrolo(12a)imidazol4ium
2(3(34DICHLOROPHENYL)67DIHYDRO5HPYRROLO(12A)IMIDAZOL1IUM1YL)ACETONITRILE
C1CC2=(N+)(C=C(N2C1)C3=CC(=C(C=C3)Cl)Cl)CC#N
InChI=1SC14H12Cl2N3c15114310(812(11)16)13918(7517)1421619(13)14h3489H1267H2q+1
N#CCn1cc((n+)2c1CCC2)c1ccc(c(c1)Cl)Cl
ZINC000017250394
ZINC17250394
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