Vitas-M small molecule compound
(E)-{2-(2-methoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL046100
SMILES COc1ccccc1C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cnn(c1C)c1ccccc1)/[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 C28H30N4O5 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5/c1-19-22(18-29-32(19)20-8-4-3-5-9-20)26(33)24-25(21-10-6-7-11-23(21)36-2)31(28(35)27(24)34)13-12-30-14-16-37-17-15-30/h3-11,18,25,33H,12-17H2,1-2H3/b26-24+InChIKey
NKRJSKAXEXKITA-SHHOIMCASA-NSynonyms
955870-37-8(4E)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)5(2METHOXYPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(2methoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(2METHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
955870378
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=CC=CC=C5OC)O
COc1ccccc1C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC28H30N4O5c11922(182932(19)208435920)26(33)2425(2110671123(21)362)31(28(35)27(24)34)131230141637171530h311182533H1217H212H3b2624+
MFCD18248782
ZINC000102879381
ZINC000102879384
Check stock
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