Vitas-M small molecule compound

(4Z)-1-(4-methylphenyl)-4-{[5-(4-nitrophenyl)furan-2-yl]methylidene}pyrazolidine-3,5-dione

Catalog ID
STL442870
SMILES Cc1ccc(cc1)N1NC(=O)/C(=C/c2ccc(o2)c2ccc(cc2)[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 C21H15N3O5 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O5/c1-13-2-6-15(7-3-13)23-21(26)18(20(25)22-23)12-17-10-11-19(29-17)14-4-8-16(9-5-14)24(27)28/h2-12H,1H3,(H,22,25)/b18-12-
InChIKey
YPMUKGGDCGLBHG-PDGQHHTCSA-N
Synonyms

(4Z)1(4methylphenyl)4((5(4nitrophenyl)furan2yl)methylidene)pyrazolidine35dione
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N2
Cc1ccc(cc1)N1NC(=O)C(=Cc2ccc(o2)c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC21H15N3O5c1132615(7313)2321(26)18(20(25)2223)1217101119(2917)144816(9514)24(27)28h212H1H3(H2225)b1812
MFCD01446251
ZINC000005541393
ZINC05541393
ZINC5541393

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Available files

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