Vitas-M small molecule compound
methyl 2-(3-{(E)-[1-(2-fluorobenzyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STK059678
SMILES COC(=O)c1ccccc1n1c(C)cc(c1C)/C=C\1/NC(=O)N(C1=O)Cc1ccccc1F
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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 C25H22FN3O4 MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O4/c1-15-12-18(16(2)29(15)22-11-7-5-9-19(22)24(31)33-3)13-21-23(30)28(25(32)27-21)14-17-8-4-6-10-20(17)26/h4-13H,14H2,1-3H3,(H,27,32)/b21-13+InChIKey
LADTYJOQWHQUMI-FYJGNVAPSA-NSynonyms
CC1=CC(=C(N1C2=CC=CC=C2C(=O)OC)C)C=C3C(=O)N(C(=O)N3)CC4=CC=CC=C4F
COC(=O)c1ccccc1n1c(C)cc(c1C)C=C1NC(=O)N(C1=O)Cc1ccccc1F
InChI=1SC25H22FN3O4c1151218(16(2)29(15)221175919(22)24(31)333)132123(30)28(25(32)2721)14178461020(17)26h413H14H213H3(H2732)b2113+
METHYL2(3((E)(1((2FLUOROPHENYL)METHYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)25DIMETHYLPYRROL1YL)BENZOATE
METHYL2(3((E)(1(2FLUOROBENZYL)25DIOXOIMIDAZOLIDIN4YLIDENE)METHYL)25DIMETHYL1HPYRROL1YL)BENZOATE
MFCD04126502
STK059678
ZINC000003659349
ZINC03659349
ZINC3659349
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