Vitas-M small molecule compound
methyl 4-[(3E)-3-[hydroxy(4-propoxyphenyl)methylidene]-1-(5-methyl-1,2-oxazol-3-yl)-4,5-dioxopyrrolidin-2-yl]benzoate
Catalog ID
STK608192
SMILES CCCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(=O)OC)c1noc(c1)C)/O
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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 C26H24N2O7 MW 476.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O7/c1-4-13-34-19-11-9-17(10-12-19)23(29)21-22(16-5-7-18(8-6-16)26(32)33-3)28(25(31)24(21)30)20-14-15(2)35-27-20/h5-12,14,22,29H,4,13H2,1-3H3/b23-21+InChIKey
QSEFQENQHRDETN-XTQSDGFTSA-NSynonyms
618876-67-8618876678
CCCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NOC(=C3)C)C4=CC=C(C=C4)C(=O)OC)O
CCCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(=O)OC)c1noc(c1)C)O
InChI=1SC26H24N2O7c1413341911917(101219)23(29)2122(165718(8616)26(32)333)28(25(31)24(21)30)201415(2)352720h512142229H413H213H3b2321+
methyl4((3E)3(hydroxy(4propoxyphenyl)methylidene)1(5methyl12oxazol3yl)45dioxopyrrolidin2yl)benzoate
METHYL4(4HYDROXY1(5METHYLISOXAZOL3YL)5OXO3((4PROPOXYPHENYL)CARBONYL)3PYRROLIN2YL)BENZOATE
MFCD08731274
ZINC000102704268
ZINC000102704276
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