Vitas-M small molecule compound
ethyl (4Z)-4-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168533
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccccc1)C)c1ccc(cc1)OCC
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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 C29H30N2O4 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O4/c1-6-34-25-15-13-24(14-16-25)31-21(5)27(29(33)35-7-2)26(28(31)32)18-22-17-19(3)30(20(22)4)23-11-9-8-10-12-23/h8-18H,6-7H2,1-5H3/b26-18-InChIKey
PQERAZLKIFRXKH-ITYLOYPMSA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccccc1)C)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=C(N(C(=C3)C)C4=CC=CC=C4)C)C2=O)C(=O)OCC)C
ETHYL(4Z)4((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((25DIMETHYL1PHENYLPYRROL3YL)METHYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ETHYL4((25DIMETHYL1PHENYL1HPYRROL3YL)METHYLENE)1(4ETHOXYPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC29H30N2O4c163425151324(141625)3121(5)27(29(33)3572)26(28(31)32)18221719(3)30(20(22)4)231198101223h818H67H215H3b2618
MFCD02951503
ZINC000000680467
ZINC00680467
ZINC680467
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.