Vitas-M small molecule compound
2-(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)-N-cyclohexyl-N-methylacetamide
Catalog ID
STL389985
SMILES O=C(N(C1CCCCC1)C)Cn1nc(c(c1C)Cl)[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 C13H19ClN4O3 MW 314.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19ClN4O3/c1-9-12(14)13(18(20)21)15-17(9)8-11(19)16(2)10-6-4-3-5-7-10/h10H,3-8H2,1-2H3InChIKey
YHOKXLUDWVKHCX-UHFFFAOYSA-NSynonyms
353455-74-02(4chloro5methyl3nitro1Hpyrazol1yl)NcyclohexylNmethylacetamide
2(4CHLORO5METHYL3NITROPYRAZOL1YL)NCYCLOHEXYLNMETHYLACETAMIDE
353455740
CC1=C(C(=NN1CC(=O)N(C)C2CCCCC2)(N+)(=O)(O))Cl
InChI=1SC13H19ClN4O3c1912(14)13(18(20)21)1517(9)811(19)16(2)106435710h10H38H212H3
MFCD00808845
O=C(N(C1CCCCC1)C)Cn1nc(c(c1C)Cl)(N+)(=O)(O)
ZINC000000325682
ZINC00325682
ZINC325682
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