Vitas-M small molecule compound
methyl (4Z)-4-{[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-1-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168542
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccc(cc1)OC)C)c1ccc(cc1)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 C28H28N2O4 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O4/c1-17-7-9-23(10-8-17)30-20(4)26(28(32)34-6)25(27(30)31)16-21-15-18(2)29(19(21)3)22-11-13-24(33-5)14-12-22/h7-16H,1-6H3/b25-16-InChIKey
FLPOBPLAKGBVLP-XYGWBWBKSA-NSynonyms
CC1=CC=C(C=C1)N2C(=C(C(=CC3=C(N(C(=C3)C)C4=CC=C(C=C4)OC)C)C2=O)C(=O)OC)C
COC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccc(cc1)OC)C)c1ccc(cc1)C
InChI=1SC28H28N2O4c1177923(10817)3020(4)26(28(32)346)25(27(30)31)16211518(2)29(19(21)3)22111324(335)141222h716H16H3b2516
METHYL(4Z)4((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)4((1(4METHOXYPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXOPYRROLE3CARBOXYLATE
METHYL4((1(4METHOXYPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)2METHYL1(4METHYLPHENYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD02951510
ZINC000000680481
ZINC00680481
ZINC680481
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.