Vitas-M small molecule compound
(E)-{2-(2,3-dimethoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL043857
SMILES COc1c(OC)cccc1C1N(CCC[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 C30H34N4O6 MW 546.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O6/c1-20-23(19-31-34(20)21-9-5-4-6-10-21)27(35)25-26(22-11-7-12-24(38-2)29(22)39-3)33(30(37)28(25)36)14-8-13-32-15-17-40-18-16-32/h4-7,9-12,19,26,35H,8,13-18H2,1-3H3/b27-25+InChIKey
PMYVUMURLRDMRJ-IMVLJIQESA-NSynonyms
955895-68-8(4E)5(23DIMETHOXYPHENYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(23dimethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(23DIMETHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
5(23DIMETHOXYPHENYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
955895688
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)4CCOCC4)C5=C(C(=CC=C5)OC)OC)(O)
COc1c(OC)cccc1C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC30H34N4O6c12023(193134(20)2195461021)27(35)2526(221171224(382)29(22)393)33(30(37)28(25)36)1481332151740181632h47912192635H81318H213H3b2725+
MFCD18248303
ZINC000102874585
ZINC000102874588
Check stock
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