Vitas-M small molecule compound
ethyl (4Z)-1-(4-ethoxyphenyl)-4-(furan-2-ylmethylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165070
SMILES CCOc1ccc(cc1)N1C(=O)/C(=C\c2ccco2)/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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-4-25-16-10-8-15(9-11-16)22-14(3)19(21(24)26-5-2)18(20(22)23)13-17-7-6-12-27-17/h6-13H,4-5H2,1-3H3/b18-13-InChIKey
KJCRZHOBFITEAG-AQTBWJFISA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=CO3)C2=O)C(=O)OCC)C
CCOc1ccc(cc1)N1C(=O)C(=Cc2ccco2)C(=C1C)C(=O)OCC
ETHYL(4Z)1(4ETHOXYPHENYL)4(2FURYLMETHYLENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)1(4ETHOXYPHENYL)4(FURAN2YLMETHYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)1(4ETHOXYPHENYL)4(FURAN2YLMETHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC21H21NO5c14251610815(91116)2214(3)19(21(24)2652)18(20(22)23)131776122717h613H45H213H3b1813
MFCD02217763
ZINC000004169903
ZINC04169903
ZINC4169903
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