Vitas-M small molecule compound

(4E)-1-butyl-5-(4-chlorophenyl)-4-[hydroxy(4-nitrophenyl)methylidene]pyrrolidine-2,3-dione

Catalog ID
STK577512
SMILES CCCCN1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=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 C21H19ClN2O5 MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5/c1-2-3-12-23-18(13-4-8-15(22)9-5-13)17(20(26)21(23)27)19(25)14-6-10-16(11-7-14)24(28)29/h4-11,18,25H,2-3,12H2,1H3/b19-17+
InChIKey
NUZQLUPBSUQMIH-HTXNQAPBSA-N
Synonyms
488851-89-4
(4E)1butyl5(4chlorophenyl)4(hydroxy(4nitrophenyl)methylidene)pyrrolidine23dione
488851894
CCCCN1C(C(=C(C2=CC=C(C=C2)(N+)(=O)(O))O)C(=O)C1=O)C3=CC=C(C=C3)Cl
CCCCN1C(c2ccc(cc2)Cl)C(=C(c2ccc(cc2)(N+)(=O)(O))O)C(=O)C1=O
InChI=1SC21H19ClN2O5c123122318(134815(22)9513)17(20(26)21(23)27)19(25)1461016(11714)24(28)29h4111825H2312H21H3b1917+
MFCD07206775
ZINC000102581787
ZINC000102581791

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Available files

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