Vitas-M small molecule compound

N-[1-(2-chlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(3-nitro-1H-pyrazol-1-yl)propanamide

Catalog ID
STK302573
SMILES O=C(Nc1c(C)nn(c1C)Cc1ccccc1Cl)CCn1ccc(n1)[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 C18H19ClN6O3 MW 402.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN6O3/c1-12-18(13(2)24(21-12)11-14-5-3-4-6-15(14)19)20-17(26)8-10-23-9-7-16(22-23)25(27)28/h3-7,9H,8,10-11H2,1-2H3,(H,20,26)
InChIKey
BBQHNQAPIFSWIF-UHFFFAOYSA-N
Synonyms
957311-78-3
957311783
CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)NC(=O)CCN3C=CC(=N3)(N+)(=O)(O)
InChI=1SC18H19ClN6O3c11218(13(2)24(2112)1114534615(14)19)2017(26)810239716(2223)25(27)28h379H81011H212H3(H2026)
MFCD04048148
N(1((2CHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)3(3NITROPYRAZOL1YL)PROPANAMIDE
N(1(2chlorobenzyl)35dimethyl1Hpyrazol4yl)3(3nitro1Hpyrazol1yl)propanamide
O=C(Nc1c(C)nn(c1C)Cc1ccccc1Cl)CCn1ccc(n1)(N+)(=O)(O)
ZINC000000653018
ZINC00653018
ZINC653018

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Available files

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