Vitas-M small molecule compound

[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(methyl)amino]methanesulfonate

Catalog ID
STK177347
SMILES CN(c1c(C)n(n(c1=O)c1ccccc1)C)CS(=O)(=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 C13H16N3O4S MW 310.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O4S/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3,(H,18,19,20)/p-1
InChIKey
LVWZTYCIRDMTEY-UHFFFAOYSA-M
Synonyms

((15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)(METHYL)AMINO)METHANESULFONATE
((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)METHYLAMINO)METHANESULFONATE
((23DIHYDRO15DIMETHYL3OXO2PHENYL1HPYRAZOL4YL)METHYLAMINO)METHANESULFONATE
(ANTIPYRINYLMETHYLAMINO)METHANESULFONATE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)CS(=O)(=O)(O)
CN(c1c(C)n(n(c1=O)c1ccccc1)C)CS(=O)(=O)(O)(Na+)
InChI=1SC13H17N3O4Sc11012(14(2)921(1819)20)13(17)16(15(10)3)117546811h48H9H213H3(H181920)p1
METAMIZOLEANION
METHANESULFONICACID1((23DIHYDRO15DIMETHYL3OXO2PHENYL1HPYRAZOL4YL)METHYLAMINO)ION(1)
MFCD00417767
N(23DIMETHYL5OXO1PHENYL3PYRAZOLIN4YL)NMETHYLAMINOMETHANESULFONATE
sodium((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)(methyl)amino)methanesulfonate
ZINC000001782155
ZINC01782155

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.