Vitas-M small molecule compound
2-({(2E)-2-cyano-3-[5-(2-methyl-4-nitrophenyl)furan-2-yl]prop-2-enoyl}amino)benzoic acid
Catalog ID
STK361980
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1C)[N+](=O)[O-])/C(=O)Nc1ccccc1C(=O)O
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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 C22H15N3O6 MW 417.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15N3O6/c1-13-10-15(25(29)30)6-8-17(13)20-9-7-16(31-20)11-14(12-23)21(26)24-19-5-3-2-4-18(19)22(27)28/h2-11H,1H3,(H,24,26)(H,27,28)/b14-11+InChIKey
IMLAYWNCIXZNCO-SDNWHVSQSA-NSynonyms
2(((2E)2CYANO3(5(2METHYL4NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOICACID
2(((E)2CYANO3(5(2METHYL4NITROPHENYL)FURAN2YL)PROP2ENOYL)AMINO)BENZOICACID
2((2E)2CYANO3(5(2METHYL4NITROPHENYL)(2FURYL))PROP2ENOYLAMINO)BENZOICACID
CC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=CC=C3C(=O)O
InChI=1SC22H15N3O6c1131015(25(29)30)6817(13)209716(3120)1114(1223)21(26)2419532418(19)22(27)28h211H1H3(H2426)(H2728)b1411+
MFCD02643770
N#CC(=Cc1ccc(o1)c1ccc(cc1C)(N+)(=O)(O))C(=O)Nc1ccccc1C(=O)O
ZINC000016158250
ZINC16158250
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