Vitas-M small molecule compound
methyl (5E)-5-(furan-2-ylmethylidene)-2-methyl-4-oxo-1-phenyl-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL036487
SMILES COC(=O)C1=C(C)N(/C(=C/c2ccco2)/C1=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 C18H15NO4 MW 309.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15NO4/c1-12-16(18(21)22-2)17(20)15(11-14-9-6-10-23-14)19(12)13-7-4-3-5-8-13/h3-11H,1-2H3/b15-11+InChIKey
XKSZXIXQQVPLER-RVDMUPIBSA-NSynonyms
(E)methyl5(furan2ylmethylene)2methyl4oxo1phenyl45dihydro1Hpyrrole3carboxylate
5(1FURAN2YLMETH(E)YLIDENE)2METHYL4OXO1PHENYL45DIHYDRO1HPYRROLE3CARBOXYLICACIDMETHYLESTER
CC1=C(C(=O)C(=CC2=CC=CO2)N1C3=CC=CC=C3)C(=O)OC
COC(=O)C1=C(C)N(C(=Cc2ccco2)C1=O)c1ccccc1
InChI=1SC18H15NO4c11216(18(21)222)17(20)15(111496102314)19(12)137435813h311H12H3b1511+
methyl(5E)5(furan2ylmethylidene)2methyl4oxo1phenyl45dihydro1Hpyrrole3carboxylate
methyl(5E)5(furan2ylmethylidene)2methyl4oxo1phenylpyrrole3carboxylate
MFCD01893964
ZINC000004811314
ZINC04811314
ZINC4811314
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