Vitas-M small molecule compound
(4Z)-4-{[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}-1-(4-methylphenyl)pyrazolidine-3,5-dione
Catalog ID
STL386492
SMILES Cc1ccc(cc1)N1NC(=O)/C(=C/c2ccc(o2)c2cc(ccc2C)[N+](=O)[O-])/C1=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 C22H17N3O5 MW 403.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5/c1-13-3-6-15(7-4-13)24-22(27)19(21(26)23-24)12-17-9-10-20(30-17)18-11-16(25(28)29)8-5-14(18)2/h3-12H,1-2H3,(H,23,26)/b19-12-InChIKey
LPWGQEHMEASIDD-UNOMPAQXSA-NSynonyms
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)(N+)(=O)(O))C)C(=O)N2
Cc1ccc(cc1)N1NC(=O)C(=Cc2ccc(o2)c2cc(ccc2C)(N+)(=O)(O))C1=O
InChI=1SC22H17N3O5c1133615(7413)2422(27)19(21(26)2324)121791020(3017)181116(25(28)29)8514(18)2h312H12H3(H2326)b1912
MFCD01788052
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