Vitas-M small molecule compound
N-(4-methoxybenzyl)-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK771076
SMILES COc1ccc(cc1)CNC(=O)c1nn(cc1[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 C13H14N4O4 MW 290.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O4/c1-16-8-11(17(19)20)12(15-16)13(18)14-7-9-3-5-10(21-2)6-4-9/h3-6,8H,7H2,1-2H3,(H,14,18)InChIKey
BHWGLTDEVLNDOF-UHFFFAOYSA-NSynonyms
1METHYL4NITRO1HPYRAZOLE3CARBOXYLICACID4METHOXYBENZYLAMIDE
CN1C=C(C(=N1)C(=O)NCC2=CC=C(C=C2)OC)(N+)(=O)(O)
COc1ccc(cc1)CNC(=O)c1nn(cc1(N+)(=O)(O))C
InChI=1SC13H14N4O4c116811(17(19)20)12(1516)13(18)14793510(212)649h368H7H212H3(H1418)
MFCD01450466
N((4METHOXYPHENYL)METHYL)(1METHYL4NITROPYRAZOL3YL)CARBOXAMIDE
N((4METHOXYPHENYL)METHYL)1METHYL4NITROPYRAZOLE3CARBOXAMIDE
N(4methoxybenzyl)1methyl4nitro1Hpyrazole3carboxamide
ZINC000000104424
ZINC00104424
ZINC104424
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