Vitas-M small molecule compound
(E)-{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STK564618
SMILES O=C1C(=O)/C(=C(\c2cccs2)/[O-])/C(N1CCCn1c[nH+]cc1)c1cccnc1
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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 C20H18N4O3S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O3S/c25-18(15-5-2-11-28-15)16-17(14-4-1-6-21-12-14)24(20(27)19(16)26)9-3-8-23-10-7-22-13-23/h1-2,4-7,10-13,17,25H,3,8-9H2/b18-16+InChIKey
JBFAFONVOREOOZ-FBMGVBCBSA-NSynonyms
(E)(1(3(1Himidazol3ium1yl)propyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)(thiophen2yl)methanolate
MFCD18244577
O=C1C(=O)C(=C(c2cccs2)(O))C(N1CCCn1c(nH+)cc1)c1cccnc1
ZINC000102528989
ZINC000102528997
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