Vitas-M small molecule compound
(E)-{2-(3-bromophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STL148031
SMILES Brc1cccc(c1)C1N(CC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cccs1)/[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 C21H21BrN2O4S MW 477.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O4S/c22-15-4-1-3-14(13-15)18-17(19(25)16-5-2-12-29-16)20(26)21(27)24(18)7-6-23-8-10-28-11-9-23/h1-5,12-13,18,25H,6-11H2/b19-17+InChIKey
VQDKJACQEPDGPI-HTXNQAPBSA-NSynonyms
(E)(2(3bromophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
Brc1cccc(c1)C1N(CC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cccs1)(O)
MFCD20755313
ZINC000008835971
ZINC000008835972
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