Vitas-M small molecule compound
(E)-{2-(3,4-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
STL148917
SMILES COc1cc(ccc1OC)C1N(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)22-8-5-4-6-9-22)28(35)26-27(21-10-11-24(38-2)25(18-21)39-3)33(30(37)29(26)36)13-7-12-32-14-16-40-17-15-32/h4-6,8-11,18-19,27,35H,7,12-17H2,1-3H3/b28-26+InChIKey
BQXQBNOWMHFUBY-BYCLXTJYSA-NSynonyms
955893-15-9(4E)5(34DIMETHOXYPHENYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(34dimethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(34DIMETHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
5(34DIMETHOXYPHENYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
955893159
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCCN4CCOCC4)C5=CC(=C(C=C5)OC)OC)O
COc1cc(ccc1OC)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC30H34N4O6c12023(193134(20)228546922)28(35)2627(21101124(382)25(1821)393)33(30(37)29(26)36)1371232141640171532h4681118192735H71217H213H3b2826+
MFCD20755499
ZINC000102931624
ZINC000102931626
Check stock
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