Vitas-M small molecule compound
(3E)-3-(3-bromo-4-methoxybenzylidene)-1-(4-methyl-3-nitrophenyl)-5-phenyl-1,3-dihydro-2H-pyrrol-2-one
Catalog ID
STK193019
SMILES COc1ccc(cc1Br)/C=C/1\C=C(N(C1=O)c1ccc(c(c1)[N+](=O)[O-])C)c1ccccc1
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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 C25H19BrN2O4 MW 491.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN2O4/c1-16-8-10-20(15-22(16)28(30)31)27-23(18-6-4-3-5-7-18)14-19(25(27)29)12-17-9-11-24(32-2)21(26)13-17/h3-15H,1-2H3/b19-12+InChIKey
ZJMJFQOASDQZGM-XDHOZWIPSA-NSynonyms
(3E)3((3bromo4methoxyphenyl)methylidene)1(4methyl3nitrophenyl)5phenylpyrrol2one
(3E)3(3BROMO4METHOXYBENZYLIDENE)1(4METHYL3NITROPHENYL)5PHENYL13DIHYDRO2HPYRROL2ONE
CC1=C(C=C(C=C1)N2C(=CC(=CC3=CC(=C(C=C3)OC)Br)C2=O)C4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1Br)C=C1C=C(N(C1=O)c1ccc(c(c1)(N+)(=O)(O))C)c1ccccc1
InChI=1SC25H19BrN2O4c11681020(1522(16)28(30)31)2723(186435718)1419(25(27)29)121791124(322)21(26)1317h315H12H3b1912+
MFCD02084299
ZINC000008872230
ZINC08872230
ZINC8872230
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