Vitas-M small molecule compound
ethyl (4Z)-1-(2-methoxyethyl)-2-methyl-5-oxo-4-[4-(propan-2-yl)benzylidene]-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168497
SMILES COCCN1C(=O)/C(=C\c2ccc(cc2)C(C)C)/C(=C1C)C(=O)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 C21H27NO4 MW 357.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO4/c1-6-26-21(24)19-15(4)22(11-12-25-5)20(23)18(19)13-16-7-9-17(10-8-16)14(2)3/h7-10,13-14H,6,11-12H2,1-5H3/b18-13-InChIKey
ZUAOALXALMUBLG-AQTBWJFISA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC=C(C=C2)C(C)C)CCOC)C
COCCN1C(=O)C(=Cc2ccc(cc2)C(C)C)C(=C1C)C(=O)OCC
ETHYL(4Z)1(2METHOXYETHYL)2METHYL5OXO4((4PROPAN2YLPHENYL)METHYLIDENE)PYRROLE3CARBOXYLATE
ETHYL(4Z)1(2METHOXYETHYL)2METHYL5OXO4(4(PROPAN2YL)BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC21H27NO4c162621(24)1915(4)22(1112255)20(23)18(19)13167917(10816)14(2)3h7101314H61112H215H3b1813
MFCD01829433
ZINC000097831236
ZINC97831236
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