Vitas-M small molecule compound
[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetic acid
Catalog ID
STK315325
SMILES OC(=O)CSc1[nH]nc(c1[N+](=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 C6H7N3O4S MW 217.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H7N3O4S/c1-3-5(9(12)13)6(8-7-3)14-2-4(10)11/h2H2,1H3,(H,7,8)(H,10,11)InChIKey
JGDROEATVKVVNF-UHFFFAOYSA-NSynonyms
879565-31-8((3methyl4nitro1Hpyrazol5yl)sulfanyl)aceticacid
((3METHYL4NITRO1HPYRAZOL5YL)THIO)ACETICACID
((5METHYL4NITRO2HPYRAZOL3YL)SULFANYL)ACETICACID
(5METHYL4NITRO2HPYRAZOL3YLSULFANYL)ACETI
(5METHYL4NITRO2HPYRAZOL3YLSULFANYL)ACETICACID
2((3METHYL4NITRO1HPYRAZOL5YL)SULFANYL)ACETICACID
2((3METHYL4NITRO1HPYRAZOL5YL)THIO)ACETICACID
2((5METHYL4NITRO1HPYRAZOL3YL)SULFANYL)ACETICACID
2(3METHYL4NITROPYRAZOL5YLTHIO)ACETICACID
879565318
CC1=C(C(=NN1)SCC(=O)O)(N+)(=O)(O)
InChI=1SC6H7N3O4Sc135(9(12)13)6(873)1424(10)11h2H21H3(H78)(H1011)
MFCD00464488
OC(=O)CSc1(nH)nc(c1(N+)(=O)(O))C
ZINC000005800363
ZINC5800363
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.