Vitas-M small molecule compound

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

Catalog ID
STK219795
SMILES Cc1cccc(c1)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/c1-13-3-2-4-16(11-13)23-21(26)18(20(25)22-23)12-17-9-10-19(29-17)14-5-7-15(8-6-14)24(27)28/h2-12H,1H3,(H,22,25)/b18-12+
InChIKey
DYJWJPKSPDBIID-LDADJPATSA-N
Synonyms

(4E)1(3METHYLPHENYL)4((5(4NITROPHENYL)FURAN2YL)METHYLIDENE)PYRAZOLIDINE35DIONE
CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)N2
Cc1cccc(c1)N1NC(=O)C(=Cc2ccc(o2)c2ccc(cc2)(N+)(=O)(O))C1=O
InChI=1SC21H15N3O5c11332416(1113)2321(26)18(20(25)2223)121791019(2917)145715(8614)24(27)28h212H1H3(H2225)b1812+
MFCD02906736
ZINC000004815213
ZINC04815213
ZINC4815213

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Available files

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