Vitas-M small molecule compound
(E)-{2-(3,4-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(5-methyl-1-phenyl-1H-pyrazol-4-yl)methanolate
Catalog ID
STL148604
SMILES COc1cc(ccc1OC)C1N(CCC[NH+](C)C)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 C28H32N4O5 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O5/c1-18-21(17-29-32(18)20-10-7-6-8-11-20)26(33)24-25(19-12-13-22(36-4)23(16-19)37-5)31(28(35)27(24)34)15-9-14-30(2)3/h6-8,10-13,16-17,25,33H,9,14-15H2,1-5H3/b26-24+InChIKey
KEKVPPABTXTEFF-SHHOIMCASA-NSynonyms
955888-35-4(4E)5(34DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(5METHYL1PHENYLPYRAZOL4YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dimethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(5methyl1phenyl1Hpyrazol4yl)methanolate
(E)(2(34DIMETHOXYPHENYL)1(3(DIMETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(5METHYL1PHENYLPYRAZOL4YL)METHANOLATE
5(34DIMETHOXYPHENYL)1(3(DIMETHYLAMINO)PROPYL)3HYDROXY4((5METHYL1PHENYLPYRAZOL4YL)CARBONYL)3PYRROLIN2ONE
955888354
CC1=C(C=NN1C2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCC(NH+)(C)C)C4=CC(=C(C=C4)OC)OC)(O)
COc1cc(ccc1OC)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1cnn(c1C)c1ccccc1)(O)
InChI=1SC28H32N4O5c11821(172932(18)20107681120)26(33)2425(19121322(364)23(1619)375)31(28(35)27(24)34)1591430(2)3h68101316172533H91415H215H3b2624+
MFCD20755428
ZINC000102927341
ZINC000102927345
Check stock
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