Vitas-M small molecule compound
ethyl 4-{5-[(1E)-3-(1,3-benzodioxol-5-ylamino)-2-cyano-3-oxoprop-1-en-1-yl]furan-2-yl}benzoate
Catalog ID
STK473104
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(/C(=O)Nc1ccc2c(c1)OCO2)\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 C24H18N2O6 MW 430.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O6/c1-2-29-24(28)16-5-3-15(4-6-16)20-10-8-19(32-20)11-17(13-25)23(27)26-18-7-9-21-22(12-18)31-14-30-21/h3-12H,2,14H2,1H3,(H,26,27)/b17-11+InChIKey
XPMQAMSOMXABRQ-GZTJUZNOSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC4=C(C=C3)OCO4
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C(C(=O)Nc1ccc2c(c1)OCO2)C#N
ETHYL4(5((1E)2(N(2HBENZO(34D)13DIOXOLAN5YL)CARBAMOYL)2CYANOVINYL)2FURYL)BENZOATE
ethyl4(5((1E)3(13benzodioxol5ylamino)2cyano3oxoprop1en1yl)furan2yl)benzoate
ethyl4(5((E)3(13benzodioxol5ylamino)2cyano3oxoprop1enyl)furan2yl)benzoate
InChI=1SC24H18N2O6c122924(28)165315(4616)2010819(3220)1117(1325)23(27)2618792122(1218)31143021h312H214H21H3(H2627)b1711+
MFCD07077002
ZINC000017096810
ZINC17096810
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