Vitas-M small molecule compound
ethyl (4Z)-4-({1-[2-(methoxycarbonyl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK161509
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1cc(n(c1C)c1ccccc1C(=O)OC)C)c1ccccc1
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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 C29H28N2O5 MW 484.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O5/c1-6-36-29(34)26-20(4)31(22-12-8-7-9-13-22)27(32)24(26)17-21-16-18(2)30(19(21)3)25-15-11-10-14-23(25)28(33)35-5/h7-17H,6H2,1-5H3/b24-17-InChIKey
SVUMMRKVDLGJKE-ULJHMMPZSA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1cc(n(c1C)c1ccccc1C(=O)OC)C)c1ccccc1
CCOC(=O)C1=C(N(C(=O)C1=CC2=C(N(C(=C2)C)C3=CC=CC=C3C(=O)OC)C)C4=CC=CC=C4)C
ETHYL(4Z)4((1(2(METHOXYCARBONYL)PHENYL)25DIMETHYL1HPYRROL3YL)METHYLIDENE)2METHYL5OXO1PHENYL45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4((1(2METHOXYCARBONYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)2METHYL5OXO1PHENYLPYRROLE3CARBOXYLATE
InChI=1SC29H28N2O5c163629(34)2620(4)31(22128791322)27(32)24(26)17211618(2)30(19(21)3)251511101423(25)28(33)355h717H6H215H3b2417
METHYL2(3((4(ETHOXYCARBONYL)5METHYL2OXO1PHENYLAZOLIN3YLIDENE)METHYL)25DIMETHYLPYRROLYL)BENZOATE
MFCD03256927
ZINC000013286410
ZINC13286410
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.