Vitas-M small molecule compound
methyl (4Z)-1-(4-fluorophenyl)-4-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165150
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(cc1)OC)C)c1ccc(cc1)F
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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 C27H25FN2O4 MW 460.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN2O4/c1-16-14-19(17(2)29(16)21-10-12-23(33-4)13-11-21)15-24-25(27(32)34-5)18(3)30(26(24)31)22-8-6-20(28)7-9-22/h6-15H,1-5H3/b24-15-InChIKey
YJGXIWBUYHVOCU-IWIPYMOSSA-NSynonyms
CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C=C3C(=C(N(C3=O)C4=CC=C(C=C4)F)C)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(cc1)OC)C)c1ccc(cc1)F
InChI=1SC27H25FN2O4c1161419(17(2)29(16)21101223(334)131121)152425(27(32)345)18(3)30(26(24)31)228620(28)7922h615H15H3b2415
METHYL(4Z)1(4FLUOROPHENYL)4((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)1(4FLUOROPHENYL)4((1(4METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
METHYL1(4FLUOROPHENYL)4((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03068008
ZINC000014010075
ZINC14010075
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.