Vitas-M small molecule compound
3-[3-(2,2-dicyanoethenyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
Catalog ID
STK197953
SMILES N#CC(=Cc1cc(n(c1C)c1cccc(c1)C(=O)O)C)C#N
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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 C17H13N3O2 MW 291.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O2/c1-11-6-15(7-13(9-18)10-19)12(2)20(11)16-5-3-4-14(8-16)17(21)22/h3-8H,1-2H3,(H,21,22)InChIKey
GNATXJZNPMOLEL-UHFFFAOYSA-NSynonyms
3(3(22DICYANOETHENYL)25DIMETHYL1HPYRROL1YL)BENZOICACID
3(3(22DICYANOETHENYL)25DIMETHYLPYRROL1YL)BENZOICACID
3(3(22dicyanovinyl)25dimethyl1Hpyrrol1yl)benzoicacid
3(3(22DICYANOVINYL)25DIMETHYLPYRROL1YL)BENZOICACID
3(3(22DICYANOVINYL)25DIMETHYLPYRROLYL)BENZOICACID
CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)O)C)C=C(C#N)C#N
InChI=1SC17H13N3O2c111615(713(918)1019)12(2)20(11)1653414(816)17(21)22h38H12H3(H2122)
MFCD02193639
ZINC000004739125
ZINC4739125
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