Vitas-M small molecule compound
(E)-{2-(4-bromophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STK562400
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Br)CCC[NH+]1CCOCC1)/[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 C25H27BrN2O5 MW 515.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27BrN2O5/c1-32-20-9-5-18(6-10-20)23(29)21-22(17-3-7-19(26)8-4-17)28(25(31)24(21)30)12-2-11-27-13-15-33-16-14-27/h3-10,22,29H,2,11-16H2,1H3/b23-21+InChIKey
DIQBYWWVSKGIOA-XTQSDGFTSA-NSynonyms
439947-81-6(4E)5(4BROMOPHENYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4bromophenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(2(4BROMOPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
439947816
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC(NH+)3CCOCC3)C4=CC=C(C=C4)Br)(O)
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Br)CCC(NH+)1CCOCC1)(O)
InChI=1SC25H27BrN2O5c132209518(61020)23(29)2122(173719(26)8417)28(25(31)24(21)30)1221127131533161427h3102229H21116H21H3b2321+
MFCD18244039
ZINC000102512237
ZINC000102512249
Check stock
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