Vitas-M small molecule compound
ethyl 3-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)benzoate
Catalog ID
STL325886
SMILES CCOC(=O)c1cccc(c1)NC(=O)/C(=C/c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/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 C23H17N3O6 MW 431.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O6/c1-2-31-23(28)16-6-3-7-18(11-16)25-22(27)17(14-24)13-20-9-10-21(32-20)15-5-4-8-19(12-15)26(29)30/h3-13H,2H2,1H3,(H,25,27)/b17-13+InChIKey
QLTRBTAKJSSPKJ-GHRIWEEISA-NSynonyms
330676-13-6(E)ethyl3(2cyano3(5(3nitrophenyl)furan2yl)acrylamido)benzoate
330676136
CCOC(=O)C1=CC(=CC=C1)NC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C#N
CCOC(=O)c1cccc(c1)NC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C#N
ethyl3(((2E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoyl)amino)benzoate
ETHYL3(((E)2CYANO3(5(3NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOATE
InChI=1SC23H17N3O6c123123(28)1663718(1116)2522(27)17(1424)132091021(3220)1554819(1215)26(29)30h313H2H21H3(H2527)b1713+
MFCD01876613
ZINC000002271940
ZINC02271940
ZINC2271940
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