Vitas-M small molecule compound
(E)-{2-(4-bromophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STK566000
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1ccc(cc1)Br)CC
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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 C22H26BrN3O3S MW 492.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrN3O3S/c1-5-25(6-2)11-12-26-18(15-7-9-16(23)10-8-15)17(20(28)22(26)29)19(27)21-13(3)24-14(4)30-21/h7-10,18,27H,5-6,11-12H2,1-4H3/b19-17+InChIKey
DHSLXWMKHGBOSV-HTXNQAPBSA-NSynonyms
(E)(2(4bromophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2sc(nc2C)C)(O))C1c1ccc(cc1)Br)CC
MFCD18244916
ZINC000102538776
ZINC000102538781
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