Vitas-M small molecule compound
[(1-benzyl-2-methyl-4-nitro-1H-imidazol-5-yl)sulfanyl]acetonitrile
Catalog ID
STL323300
SMILES N#CCSc1c(nc(n1Cc1ccccc1)C)[N+](=O)[O-]
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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 C13H12N4O2S MW 288.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12N4O2S/c1-10-15-12(17(18)19)13(20-8-7-14)16(10)9-11-5-3-2-4-6-11/h2-6H,8-9H2,1H3InChIKey
YUPALGLTKSVHKV-UHFFFAOYSA-NSynonyms
77952-79-5((1benzyl2methyl4nitro1Himidazol5yl)sulfanyl)acetonitrile
((1BENZYL2METHYL4NITRO1HIMIDAZOL5YL)THIO)ACETONITRILE
(3BENZYL2METHYL5NITRO3HIMIDAZOL4YLSULFANYL)ACETONITRILE
2((1benzyl2methyl4nitro1Himidazol5yl)thio)acetonitrile
2(3BENZYL2METHYL5NITROIMIDAZOL4YL)SULFANYLACETONITRILE
77952795
ACETONITRILE((1BENZYL2METHYL4NITRO1HIMIDAZOL5YL)THIO)
CC1=NC(=C(N1CC2=CC=CC=C2)SCC#N)(N+)(=O)(O)
InChI=1SC13H12N4O2Sc1101512(17(18)19)13(208714)16(10)9115324611h26H89H21H3
MFCD00605667
N#CCSc1c(nc(n1Cc1ccccc1)C)(N+)(=O)(O)
ZINC000002033248
ZINC02033248
ZINC2033248
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