Vitas-M small molecule compound
4-chloro-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-2-nitrobenzamide
Catalog ID
STK442397
SMILES N#Cc1c(NC(=O)c2ccc(cc2[N+](=O)[O-])Cl)sc(c1CC)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 C15H12ClN3O3S MW 349.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12ClN3O3S/c1-3-10-8(2)23-15(12(10)7-17)18-14(20)11-5-4-9(16)6-13(11)19(21)22/h4-6H,3H2,1-2H3,(H,18,20)InChIKey
GIHXEYACYGADDO-UHFFFAOYSA-NSynonyms
(4CHLORO2NITROPHENYL)N(3CYANO4ETHYL5METHYL(2THIENYL))CARBOXAMIDE
4chloroN(3cyano4ethyl5methylthiophen2yl)2nitrobenzamide
CCC1=C(SC(=C1C#N)NC(=O)C2=C(C=C(C=C2)Cl)(N+)(=O)(O))C
InChI=1SC15H12ClN3O3Sc13108(2)2315(12(10)717)1814(20)11549(16)613(11)19(21)22h46H3H212H3(H1820)
MFCD03377791
N#Cc1c(NC(=O)c2ccc(cc2(N+)(=O)(O))Cl)sc(c1CC)C
ZINC000002750617
ZINC02750617
ZINC2750617
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