Vitas-M small molecule compound
(2E)-3-[1-(biphenyl-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-(2-methylphenyl)prop-2-enamide
Catalog ID
STK182290
SMILES N#C/C(=C\c1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)/C(=O)Nc1ccccc1C
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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 C29H25N3O MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O/c1-20-9-7-8-12-28(20)31-29(33)26(19-30)18-25-17-21(2)32(22(25)3)27-15-13-24(14-16-27)23-10-5-4-6-11-23/h4-18H,1-3H3,(H,31,33)/b26-18+InChIKey
IUUAIXSRAKHBML-NLRVBDNBSA-NSynonyms
(2E)3(1(BIPHENYL4YL)25DIMETHYL1HPYRROL3YL)2CYANON(2METHYLPHENYL)PROP2ENAMIDE
(E)2CYANO3(25DIMETHYL1(4PHENYLPHENYL)PYRROL3YL)N(2METHYLPHENYL)PROP2ENAMIDE
CC1=CC=CC=C1NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)C4=CC=CC=C4)C)C#N
InChI=1SC29H25N3Oc1209781228(20)3129(33)26(1930)18251721(2)32(22(25)3)27151324(141627)23105461123h418H13H3(H3133)b2618+
MFCD02052282
N#CC(=Cc1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)C(=O)Nc1ccccc1C
ZINC000002860135
ZINC02860135
ZINC2860135
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