Vitas-M small molecule compound
methyl (4Z)-4-(4-bromobenzylidene)-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK160853
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)Br)C(c1ccccc1)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 C22H20BrNO3 MW 426.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO3/c1-14(17-7-5-4-6-8-17)24-15(2)20(22(26)27-3)19(21(24)25)13-16-9-11-18(23)12-10-16/h4-14H,1-3H3/b19-13-InChIKey
VJXQGQXLUJQAEQ-UYRXBGFRSA-NSynonyms
CC1=C(C(=CC2=CC=C(C=C2)Br)C(=O)N1C(C)C3=CC=CC=C3)C(=O)OC
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)Br)C(c1ccccc1)C
InChI=1SC22H20BrNO3c114(177546817)2415(2)20(22(26)273)19(21(24)25)131691118(23)121016h414H13H3b1913
METHYL(4Z)4((4BROMOPHENYL)METHYLIDENE)2METHYL5OXO1(1PHENYLETHYL)PYRROLE3CARBOXYLATE
METHYL(4Z)4(4BROMOBENZYLIDENE)2METHYL5OXO1(1PHENYLETHYL)45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03762700
ZINC000009845947
ZINC000009845948
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