Vitas-M small molecule compound
(2Z)-2-cyano-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-3-[5-(4-nitrophenyl)furan-2-yl]prop-2-enamide
Catalog ID
STK467342
SMILES N#C/C(=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])/C(=O)Nc1sc(c(c1C#N)CC)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 C22H16N4O4S MW 432.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4O4S/c1-3-18-13(2)31-22(19(18)12-24)25-21(27)15(11-23)10-17-8-9-20(30-17)14-4-6-16(7-5-14)26(28)29/h4-10H,3H2,1-2H3,(H,25,27)/b15-10-InChIKey
ZUOCOHABJBVUKZ-GDNBJRDFSA-NSynonyms
(2Z)2CYANON(3CYANO4ETHYL5METHYL(2THIENYL))3(5(4NITROPHENYL)(2FURYL))PROP2ENAMIDE
(2Z)2cyanoN(3cyano4ethyl5methylthiophen2yl)3(5(4nitrophenyl)furan2yl)prop2enamide
(Z)2cyanoN(3cyano4ethyl5methylthiophen2yl)3(5(4nitrophenyl)furan2yl)prop2enamide
CCC1=C(SC(=C1C#N)NC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C#N)C
InChI=1SC22H16N4O4Sc131813(2)3122(19(18)1224)2521(27)15(1123)10178920(3017)144616(7514)26(28)29h410H3H212H3(H2527)b1510
MFCD09590690
N#CC(=Cc1ccc(o1)c1ccc(cc1)(N+)(=O)(O))C(=O)Nc1sc(c(c1C#N)CC)C
ZINC000017097907
ZINC17097907
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