Vitas-M small molecule compound
2-{[1-(4-methyl-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}pyridine-3-carboxylic acid
Catalog ID
STL019668
SMILES Cc1ccc(c(c1)[N+](=O)[O-])N1C(=O)CC(C1=O)Sc1ncccc1C(=O)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 C17H13N3O6S MW 387.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O6S/c1-9-4-5-11(12(7-9)20(25)26)19-14(21)8-13(16(19)22)27-15-10(17(23)24)3-2-6-18-15/h2-7,13H,8H2,1H3,(H,23,24)InChIKey
WJDWLQHWBWZYLD-UHFFFAOYSA-NSynonyms
643746-45-62((1(4methyl2nitrophenyl)25dioxopyrrolidin3yl)sulfanyl)pyridine3carboxylicacid
2((1(4METHYL2NITROPHENYL)25DIOXOPYRROLIDIN3YL)THIO)NICOTINICACID
2(1(4METHYL2NITROPHENYL)25DIOXOAZOLIDIN3YLTHIO)PYRIDINE3CARBOXYLICACID
2(1(4METHYL2NITROPHENYL)25DIOXOPYRROLIDIN3YL)SULFANYLPYRIDINE3CARBOXYLICACID
643746456
CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C=CC=N3)C(=O)O)(N+)(=O)(O)
Cc1ccc(c(c1)(N+)(=O)(O))N1C(=O)CC(C1=O)Sc1ncccc1C(=O)O
InChI=1SC17H13N3O6Sc194511(12(79)20(25)26)1914(21)813(16(19)22)271510(17(23)24)3261815h2713H8H21H3(H2324)
MFCD03545045
ZINC000004301718
ZINC000019878614
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