Vitas-M small molecule compound
ethyl (4Z)-4-(4-hydroxy-3-methoxybenzylidene)-2-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK698679
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(c(c1)OC)O)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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-4-28-22(26)20-14(2)23(16-8-6-5-7-9-16)21(25)17(20)12-15-10-11-18(24)19(13-15)27-3/h5-13,24H,4H2,1-3H3/b17-12-InChIKey
BODDTBHDZXKEHQ-ATVHPVEESA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(c(c1)OC)O)c1ccccc1
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC(=C(C=C2)O)OC)C3=CC=CC=C3)C
ETHYL(4Z)4((4HYDROXY3METHOXYPHENYL)METHYLIDENE)2METHYL5OXO1PHENYLPYRROLE3CARBOXYLATE
ETHYL(4Z)4(4HYDROXY3METHOXYBENZYLIDENE)2METHYL5OXO1PHENYL45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL4(4HYDROXY3METHOXYBENZYLIDENE)2METHYL5OXO1PHENYL45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC22H21NO5c142822(26)2014(2)23(168657916)21(25)17(20)1215101118(24)19(1315)273h51324H4H213H3b1712
MFCD01305086
ZINC000012413420
ZINC12413420
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