Vitas-M small molecule compound
2-{[2,5-dimethyl-1-(4-methyl-3-nitrophenyl)-1H-pyrrol-3-yl]methylidene}-1H-indene-1,3(2H)-dione
Catalog ID
STK161280
SMILES [O-][N+](=O)c1cc(ccc1C)n1c(C)cc(c1C)/C=C/1\C(=O)c2c(C1=O)cccc2
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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 C23H18N2O4 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N2O4/c1-13-8-9-17(12-21(13)25(28)29)24-14(2)10-16(15(24)3)11-20-22(26)18-6-4-5-7-19(18)23(20)27/h4-12H,1-3H3InChIKey
NZFQLLNSPQWEEH-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cc(ccc1C)n1c(C)cc(c1C)C=C1C(=O)c2c(C1=O)cccc2
2((25DIMETHYL1(4METHYL3NITROPHENYL)1HPYRROL3YL)METHYLIDENE)1HINDENE13(2H)DIONE
2((25DIMETHYL1(4METHYL3NITROPHENYL)PYRROL3YL)METHYLIDENE)INDENE13DIONE
CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)C4=CC=CC=C4C3=O)C)(N+)(=O)(O)
InChI=1SC23H18N2O4c1138917(1221(13)25(28)29)2414(2)1016(15(24)3)112022(26)18645719(18)23(20)27h412H13H3
MFCD02629190
ZINC000001166951
ZINC01166951
ZINC1166951
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