Vitas-M small molecule compound
4-(5-{(1E)-2-cyano-3-[(2-methyl-5-nitrophenyl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoic acid
Catalog ID
STK093463
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)C(=O)O)/C(=O)Nc1cc(ccc1C)[N+](=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/c1-13-2-7-17(25(29)30)11-19(13)24-21(26)16(12-23)10-18-8-9-20(31-18)14-3-5-15(6-4-14)22(27)28/h2-11H,1H3,(H,24,26)(H,27,28)/b16-10+InChIKey
QKRYFOBXCHJYOB-MHWRWJLKSA-NSynonyms
345241-03-4345241034
4(5((1E)2CYANO3((2METHYL5NITROPHENYL)AMINO)3OXOPROP1EN1YL)FURAN2YL)BENZOICACID
4(5((E)2CYANO3(2METHYL5NITROANILINO)3OXOPROP1ENYL)FURAN2YL)BENZOICACID
CC1=C(C=C(C=C1)(N+)(=O)(O))NC(=O)C(=CC2=CC=C(O2)C3=CC=C(C=C3)C(=O)O)C#N
InChI=1SC22H15N3O6c1132717(25(29)30)1119(13)2421(26)16(1223)10188920(3118)143515(6414)22(27)28h211H1H3(H2426)(H2728)b1610+
MFCD02609430
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)C(=O)Nc1cc(ccc1C)(N+)(=O)(O)
STK093463
ZINC000002801747
ZINC2801747
Check stock
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