Vitas-M small molecule compound
(E)-{2-(2,3-dimethoxyphenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL037640
SMILES COc1c(OC)cccc1C1N(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 C29H32N4O6 MW 532.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O6/c1-19-22(18-30-33(19)20-8-5-4-6-9-20)26(34)24-25(21-10-7-11-23(37-2)28(21)38-3)32(29(36)27(24)35)13-12-31-14-16-39-17-15-31/h4-11,18,25,34H,12-17H2,1-3H3/b26-24+InChIKey
NHWUUBKOZXSMDD-SHHOIMCASA-NSynonyms
955898-84-7(4E)5(23DIMETHOXYPHENYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(2(23dimethoxyphenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(23DIMETHOXYPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
5(23DIMETHOXYPHENYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)1(2MORPHOLIN4YLETHYL)3PYRROLIN2ONE
955898847
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCN4CCOCC4)C5=C(C(=CC=C5)OC)OC)O
COc1c(OC)cccc1C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC29H32N4O6c11922(183033(19)208546920)26(34)2425(211071123(372)28(21)383)32(29(36)27(24)35)131231141639171531h411182534H1217H213H3b2624+
MFCD18247464
ZINC000102859045
ZINC000102859049
Check stock
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