Vitas-M small molecule compound
ethyl 2-({(2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)benzoate
Catalog ID
STK949401
SMILES CCOC(=O)c1ccccc1NC(=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)19-8-3-4-9-20(19)25-22(27)16(14-24)13-18-10-11-21(32-18)15-6-5-7-17(12-15)26(29)30/h3-13H,2H2,1H3,(H,25,27)/b16-13+InChIKey
VXHXNBIZFVCTCD-DTQAZKPQSA-NSynonyms
327062-76-0327062760
CCOC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C#N
CCOC(=O)c1ccccc1NC(=O)C(=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O))C#N
ethyl2(((2E)2cyano3(5(3nitrophenyl)furan2yl)prop2enoyl)amino)benzoate
ETHYL2(((E)2CYANO3(5(3NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOATE
ETHYL2((2E)2CYANO3(5(3NITROPHENYL)(2FURYL))PROP2ENOYLAMINO)BENZOATE
InChI=1SC23H17N3O6c123123(28)19834920(19)2522(27)16(1424)1318101121(3218)1565717(1215)26(29)30h313H2H21H3(H2527)b1613+
MFCD02354084
ZINC000001453290
ZINC01453290
ZINC1453290
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