Vitas-M small molecule compound
3-{(1E)-2-cyano-3-[(2-methylphenyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-methoxybenzoate
Catalog ID
STK522852
SMILES COc1ccc(cc1)C(=O)Oc1cccc(c1)/C=C(/C(=O)Nc1ccccc1C)\C#N
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C25H20N2O4 MW 412.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N2O4/c1-17-6-3-4-9-23(17)27-24(28)20(16-26)14-18-7-5-8-22(15-18)31-25(29)19-10-12-21(30-2)13-11-19/h3-15H,1-2H3,(H,27,28)/b20-14+InChIKey
PVQCDWKXJSXCGR-XSFVSMFZSA-NSynonyms
(3((E)2CYANO3(2METHYLANILINO)3OXOPROP1ENYL)PHENYL)4METHOXYBENZOATE
3((1E)2cyano3((2methylphenyl)amino)3oxoprop1en1yl)phenyl4methoxybenzoate
CC1=CC=CC=C1NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)OC)C#N
COc1ccc(cc1)C(=O)Oc1cccc(c1)C=C(C(=O)Nc1ccccc1C)C#N
InChI=1SC25H20N2O4c117634923(17)2724(28)20(1626)141875822(1518)3125(29)19101221(302)131119h315H12H3(H2728)b2014+
MFCD03155206
ZINC000001439435
ZINC01439435
ZINC1439435
Check stock
See real-time availability and sample size for STK522852 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.