Vitas-M small molecule compound
4-methyl-5-(5-nitro-1-benzothiophen-2-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK118637
SMILES [O-][N+](=O)c1ccc2c(c1)cc(s2)c1nnc(n1C)S
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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 C11H8N4O2S2 MW 292.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8N4O2S2/c1-14-10(12-13-11(14)18)9-5-6-4-7(15(16)17)2-3-8(6)19-9/h2-5H,1H3,(H,13,18)InChIKey
QOJCMLYGKSOBQG-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc2c(c1)cc(s2)c1nnc(n1C)S
4METHYL3(5NITRO1BENZOTHIOPHEN2YL)1H124TRIAZOLE5THIONE
4METHYL5(5NITRO1BENZOTHIOPHEN2YL)4H124TRIAZOLE3THIOL
CN1C(=NNC1=S)C2=CC3=C(S2)C=CC(=C3)(N+)(=O)(O)
InChI=1SC11H8N4O2S2c11410(121311(14)18)95647(15(16)17)238(6)199h25H1H3(H1318)
MFCD04128419
ZINC000006861553
ZINC6861553
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