Vitas-M small molecule compound
(E)-{2-(4-bromophenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL046596
SMILES C[NH+](CCN1C(c2ccc(cc2)Br)/C(=C(/c2cnn(c2C)c2ccccc2)\[O-])/C(=O)C1=O)C
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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 C25H25BrN4O3 MW 509.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN4O3/c1-16-20(15-27-30(16)19-7-5-4-6-8-19)23(31)21-22(17-9-11-18(26)12-10-17)29(14-13-28(2)3)25(33)24(21)32/h4-12,15,22,31H,13-14H2,1-3H3/b23-21+InChIKey
JYVJOTXMMAOSFR-XTQSDGFTSA-NSynonyms
955899-62-4(4E)5(4BROMOPHENYL)1(2DIMETHYLAMINOETHYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4bromophenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(4BROMOPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)5(4BROMOPHENYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)3PYRROLIN2ONE
955899624
C(NH+)(CCN1C(c2ccc(cc2)Br)C(=C(c2cnn(c2C)c2ccccc2)(O))C(=O)C1=O)C
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CC(NH+)(C)C)C4=CC=C(C=C4)Br)(O)
InChI=1SC25H25BrN4O3c11620(152730(16)197546819)23(31)2122(1791118(26)121017)29(141328(2)3)25(33)24(21)32h412152231H1314H213H3b2321+
MFCD18248882
ZINC000102881333
ZINC000102881334
Check stock
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