Vitas-M small molecule compound
5-(5-sulfanyl-1H-tetrazol-1-yl)-2-benzofuran-1(3H)-one
Catalog ID
STL389034
SMILES O=C1OCc2c1ccc(c2)n1nnnc1S
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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 C9H6N4O2S MW 234.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6N4O2S/c14-8-7-2-1-6(3-5(7)4-15-8)13-9(16)10-11-12-13/h1-3H,4H2,(H,10,12,16)InChIKey
BESMIRDNRLJUMM-UHFFFAOYSA-NSynonyms
5(5MERCAPTOTETRAZOL1YL)3HISOBENZOFURAN1ONE
5(5SULFANYL1HTETRAAZOL1YL)2BENZOFURAN1(3H)ONE
5(5sulfanyl1Htetrazol1yl)2benzofuran1(3H)one
5(5SULFANYLIDENE2HTETRAZOL1YL)3H2BENZOFURAN1ONE
C1C2=C(C=CC(=C2)N3C(=S)N=NN3)C(=O)O1
InChI=1SC9H6N4O2Sc1487216(35(7)4158)139(16)10111213h13H4H2(H101216)
ISOBENZOFURAN1(3H)ONE13DIHYDRO5(5MERCAPTO1TETRAZOLYL)
MFCD02327158
ZINC000005450550
ZINC5450550
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