Vitas-M small molecule compound

2-{[1-(2-methoxy-4-nitrophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1H-indene-1,3(2H)-dione

Catalog ID
STK165283
SMILES COc1cc(ccc1n1c(C)cc(c1C)/C=C/1\C(=O)c2c(C1=O)cccc2)[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 C23H18N2O5 MW 402.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O5/c1-13-10-15(11-19-22(26)17-6-4-5-7-18(17)23(19)27)14(2)24(13)20-9-8-16(25(28)29)12-21(20)30-3/h4-12H,1-3H3
InChIKey
NJXGNZWDGHTBIH-UHFFFAOYSA-N
Synonyms

2((1(2METHOXY4NITROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)1HINDENE13(2H)DIONE
2((1(2METHOXY4NITROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)INDENE13DIONE
CC1=CC(=C(N1C2=C(C=C(C=C2)(N+)(=O)(O))OC)C)C=C3C(=O)C4=CC=CC=C4C3=O
COc1cc(ccc1n1c(C)cc(c1C)C=C1C(=O)c2c(C1=O)cccc2)(N+)(=O)(O)
InChI=1SC23H18N2O5c1131015(111922(26)17645718(17)23(19)27)14(2)24(13)209816(25(28)29)1221(20)303h412H13H3
MFCD03141874
ZINC000001106140
ZINC01106140
ZINC1106140

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Available files

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