Vitas-M small molecule compound
methyl 3-{[(2Z)-6-(methylsulfonyl)-1,3-benzothiazol-2(3H)-ylidene]carbamoyl}-5-nitrobenzoate
Catalog ID
STK848874
SMILES COC(=O)c1cc(cc(c1)[N+](=O)[O-])C(=O)/N=c\1/[nH]c2c(s1)cc(cc2)S(=O)(=O)C
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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 C17H13N3O7S2 MW 435.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O7S2/c1-27-16(22)10-5-9(6-11(7-10)20(23)24)15(21)19-17-18-13-4-3-12(29(2,25)26)8-14(13)28-17/h3-8H,1-2H3,(H,18,19,21)InChIKey
WSXDQAFDIHYFAY-UHFFFAOYSA-NSynonyms
349439-97-0349439970
COC(=O)c1cc(cc(c1)(N+)(=O)(O))C(=O)N=c1(nH)c2c(s1)cc(cc2)S(=O)(=O)C
MFCD07204926
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