Vitas-M small molecule compound
methyl (6-nitro-3-oxo-1,2-benzothiazol-2(3H)-yl)acetate
Catalog ID
STK765528
SMILES COC(=O)Cn1sc2c(c1=O)ccc(c2)[N+](=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 C10H8N2O5S MW 268.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8N2O5S/c1-17-9(13)5-11-10(14)7-3-2-6(12(15)16)4-8(7)18-11/h2-4H,5H2,1H3InChIKey
UERUHGSDKZNTSS-UHFFFAOYSA-NSynonyms
3OXO6NITRO23DIHYDRO12BENZISOTHIAZOLE2ACETICACIDMETHYLESTER
BENZO(D)ISOTHIAZOL3(2H)ONE2(2METHOXY2OXOETHYL)6NITRO
COC(=O)CN1C(=O)C2=C(S1)C=C(C=C2)(N+)(=O)(O)
COC(=O)Cn1sc2c(c1=O)ccc(c2)(N+)(=O)(O)
InChI=1SC10H8N2O5Sc1179(13)51110(14)7326(12(15)16)48(7)1811h24H5H21H3
METHYL(6NITRO3OXO12BENZISOTHIAZOL2(3H)YL)ACETATE
methyl(6nitro3oxo12benzothiazol2(3H)yl)acetate
METHYL2(6NITRO3OXO12BENZOTHIAZOL2YL)ACETATE
MFCD02933774
ZINC000000089521
ZINC00089521
ZINC89521
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