Vitas-M small molecule compound
N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide
Catalog ID
STK021143
SMILES COc1cc(C(=O)Nc2nnc(s2)C2CCCCC2)c(cc1OC)[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 C17H20N4O5S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O5S/c1-25-13-8-11(12(21(23)24)9-14(13)26-2)15(22)18-17-20-19-16(27-17)10-6-4-3-5-7-10/h8-10H,3-7H2,1-2H3,(H,18,20,22)InChIKey
RFPXEPMAFLDHQZ-UHFFFAOYSA-NSynonyms
524677-21-2(45DIMETHOXY2NITROPHENYL)N(5CYCLOHEXYL(134THIADIAZOL2YL))CARBOXAMIDE
524677212
COC1=C(C=C(C(=C1)C(=O)NC2=NN=C(S2)C3CCCCC3)(N+)(=O)(O))OC
COc1cc(C(=O)Nc2nnc(s2)C2CCCCC2)c(cc1OC)(N+)(=O)(O)
InChI=1SC17H20N4O5Sc12513811(12(21(23)24)914(13)262)15(22)1817201916(2717)106435710h810H37H212H3(H182022)
MFCD03616227
N(5CYCLOHEXYL134THIADIAZOL2YL)45DIMETHOXY2NITROBENZAMIDE
STK021143
ZINC000001116553
ZINC01116553
ZINC1116553
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