Vitas-M small molecule compound
4,5-dimethyl-2-{[(E)-(4-nitrophenyl)methylidene]amino}thiophene-3-carbonitrile
Catalog ID
STK748997
SMILES N#Cc1c(/N=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C
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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 C14H11N3O2S MW 285.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O2S/c1-9-10(2)20-14(13(9)7-15)16-8-11-3-5-12(6-4-11)17(18)19/h3-6,8H,1-2H3/b16-8+InChIKey
BWSMPCSQNYWHFU-LZYBPNLTSA-NSynonyms
45DIMETHYL2(((E)(4NITROPHENYL)METHYLIDENE)AMINO)THIOPHENE3CARBONITRILE
45dimethyl2((E)(4nitrophenyl)methylideneamino)thiophene3carbonitrile
CC1=C(SC(=C1C#N)N=CC2=CC=C(C=C2)(N+)(=O)(O))C
InChI=1SC14H11N3O2Sc1910(2)2014(13(9)715)168113512(6411)17(18)19h368H12H3b168+
MFCD00735358
N#Cc1c(N=Cc2ccc(cc2)(N+)(=O)(O))sc(c1C)C
ZINC000000059333
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