Vitas-M small molecule compound
(E)-(2,4-dimethyl-1,3-thiazol-5-yl){1-[2-(morpholin-4-ium-4-yl)ethyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL148248
SMILES Cc1nc(c(s1)/C(=C\1/C(c2cccc(c2)[N+](=O)[O-])N(C(=O)C1=O)CC[NH+]1CCOCC1)/[O-])C
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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 C22H24N4O6S MW 472.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O6S/c1-13-21(33-14(2)23-13)19(27)17-18(15-4-3-5-16(12-15)26(30)31)25(22(29)20(17)28)7-6-24-8-10-32-11-9-24/h3-5,12,18,27H,6-11H2,1-2H3/b19-17+InChIKey
DFSFLWGJCXCAOL-HTXNQAPBSA-NSynonyms
(E)(24dimethyl13thiazol5yl)(1(2(morpholin4ium4yl)ethyl)2(3nitrophenyl)45dioxopyrrolidin3ylidene)methanolate
Cc1nc(c(s1)C(=C1C(c2cccc(c2)(N+)(=O)(O))N(C(=O)C1=O)CC(NH+)1CCOCC1)(O))C
MFCD20755358
ZINC000102926074
ZINC000102926077
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