Vitas-M small molecule compound
(2E)-2-cyano-N-cyclohexyl-3-[2,5-dimethyl-1-(4-nitrophenyl)-1H-pyrrol-3-yl]prop-2-enamide
Catalog ID
STK005648
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)[N+](=O)[O-])C)/C(=O)NC1CCCCC1
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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 C22H24N4O3 MW 392.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3/c1-15-12-17(13-18(14-23)22(27)24-19-6-4-3-5-7-19)16(2)25(15)20-8-10-21(11-9-20)26(28)29/h8-13,19H,3-7H2,1-2H3,(H,24,27)/b18-13+InChIKey
DKCZLQHLWCLBCG-QGOAFFKASA-NSynonyms
(2E)2CYANONCYCLOHEXYL3(25DIMETHYL1(4NITROPHENYL)1HPYRROL3YL)PROP2ENAMIDE
(E)2CYANONCYCLOHEXYL3(25DIMETHYL1(4NITROPHENYL)PYRROL3YL)PROP2ENAMIDE
CC1=CC(=C(N1C2=CC=C(C=C2)(N+)(=O)(O))C)C=C(C#N)C(=O)NC3CCCCC3
InChI=1SC22H24N4O3c1151217(1318(1423)22(27)24196435719)16(2)25(15)2081021(11920)26(28)29h81319H37H212H3(H2427)b1813+
MFCD02196961
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)(N+)(=O)(O))C)C(=O)NC1CCCCC1
STK005648
ZINC000004550341
ZINC04550341
ZINC4550341
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