Vitas-M small molecule compound
ethyl (4Z)-4-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-2-methyl-1-(4-methylphenyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK040271
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccccc1)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 C28H28N2O3 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O3/c1-6-33-28(32)26-21(5)30(24-14-12-18(2)13-15-24)27(31)25(26)17-22-16-19(3)29(20(22)4)23-10-8-7-9-11-23/h7-17H,6H2,1-5H3/b25-17-InChIKey
WQWJJQNMZXNYNB-UQQQWYQISA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccccc1)C)c1ccc(cc1)C
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC=CC=C3)C)C4=CC=C(C=C4)C)C
ETHYL(4Z)4((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((25DIMETHYL1PHENYLPYRROL3YL)METHYLIDENE)2METHYL1(4METHYLPHENYL)5OXOPYRROLE3CARBOXYLATE
ETHYL4((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLENE)2METHYL1(4METHYLPHENYL)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC28H28N2O3c163328(32)2621(5)30(24141218(2)131524)27(31)25(26)17221619(3)29(20(22)4)23108791123h717H6H215H3b2517
MFCD02945736
STK040271
ZINC000013942407
ZINC13942407
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.