Vitas-M small molecule compound
1-(difluoromethyl)-N-[3-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propyl]-3-methyl-1H-pyrazole-4-sulfonamide
Catalog ID
STL395332
SMILES COc1nn(cc1[N+](=O)[O-])CCCNS(=O)(=O)c1cn(nc1C)C(F)F
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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 C12H16F2N6O5S MW 394.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16F2N6O5S/c1-8-10(7-19(16-8)12(13)14)26(23,24)15-4-3-5-18-6-9(20(21)22)11(17-18)25-2/h6-7,12,15H,3-5H2,1-2H3InChIKey
HYDQVKXDUGOPTL-UHFFFAOYSA-NSynonyms
1006994-40-61(DIFLUOROMETHYL)N(3(3METHOXY4NITRO1HPYRAZOL1YL)PROPYL)3METHYL1HPYRAZOLE4SULFONAMIDE
1(difluoromethyl)N(3(3methoxy4nitropyrazol1yl)propyl)3methylpyrazole4sulfonamide
1006994406
CC1=NN(C=C1S(=O)(=O)NCCCN2C=C(C(=N2)OC)(N+)(=O)(O))C(F)F
COc1nn(cc1(N+)(=O)(O))CCCNS(=O)(=O)c1cn(nc1C)C(F)F
InChI=1SC12H16F2N6O5Sc1810(719(168)12(13)14)26(2324)154351869(20(21)22)11(1718)252h671215H35H212H3
MFCD08556464
ZINC000036614934
ZINC36614934
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