Vitas-M small molecule compound
1-cyclopentyl-6,7-dihydroxy-4-(5-nitrothiophen-2-yl)-1,2-dihydro-3H-[1]benzofuro[3,2-b]pyrazolo[4,3-e]pyridin-3-one
Catalog ID
STL312819
SMILES [O-][N+](=O)c1ccc(s1)c1c2oc3c(c2nc2c1c(=O)[nH]n2C1CCCC1)ccc(c3O)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 C21H16N4O6S MW 452.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N4O6S/c26-11-6-5-10-16-19(31-18(10)17(11)27)14(12-7-8-13(32-12)25(29)30)15-20(22-16)24(23-21(15)28)9-3-1-2-4-9/h5-9,26-27H,1-4H2,(H,23,28)InChIKey
YDGUBLHPXKHYOI-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(s1)c1c2oc3c(c2nc2c1c(=O)(nH)n2C1CCCC1)ccc(c3O)O
1cyclopentyl67dihydroxy4(5nitrothiophen2yl)12dihydro3H(1)benzofuro(32b)pyrazolo(43e)pyridin3one
1cyclopentyl67dihydroxy4(5nitrothiophen2yl)1Hbenzofuro(32b)pyrazolo(43e)pyridin3(2H)one
MFCD23137525
ZINC000095475067
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