Vitas-M small molecule compound
4-{(3E)-3-[(5-nitrothiophen-2-yl)methylidene]-2,5-dioxopyrrolidin-1-yl}benzoic acid
Catalog ID
STK623277
SMILES O=C1C/C(=C\c2ccc(s2)[N+](=O)[O-])/C(=O)N1c1ccc(cc1)C(=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 C16H10N2O6S MW 358.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10N2O6S/c19-13-8-10(7-12-5-6-14(25-12)18(23)24)15(20)17(13)11-3-1-9(2-4-11)16(21)22/h1-7H,8H2,(H,21,22)/b10-7+InChIKey
HBNQWOWFLLTWJD-JXMROGBWSA-NSynonyms
929820-70-2(E)4(3((5nitrothiophen2yl)methylene)25dioxopyrrolidin1yl)benzoicacid
4((3E)3((5nitrothiophen2yl)methylidene)25dioxopyrrolidin1yl)benzoicacid
929820702
C1C(=CC2=CC=C(S2)(N+)(=O)(O))C(=O)N(C1=O)C3=CC=C(C=C3)C(=O)O
InChI=1SC16H10N2O6Sc1913810(7125614(2512)18(23)24)15(20)17(13)11319(2411)16(21)22h17H8H2(H2122)b107+
MFCD09797615
O=C1CC(=Cc2ccc(s2)(N+)(=O)(O))C(=O)N1c1ccc(cc1)C(=O)O
ZINC000009047315
ZINC9047315
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