Vitas-M small molecule compound

1-(2,6-dimethylmorpholin-4-yl)-2-(3-methyl-4-nitro-1H-pyrazol-1-yl)propan-1-one

Catalog ID
STK964248
SMILES CC1OC(C)CN(C1)C(=O)C(n1nc(c(c1)[N+](=O)[O-])C)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 C13H20N4O4 MW 296.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N4O4/c1-8-5-15(6-9(2)21-8)13(18)11(4)16-7-12(17(19)20)10(3)14-16/h7-9,11H,5-6H2,1-4H3
InChIKey
YPJCFGLSLLYLPM-UHFFFAOYSA-N
Synonyms
1024272-47-6
1(26dimethylmorpholin4yl)2(3methyl4nitro1Hpyrazol1yl)propan1one
1(26DIMETHYLMORPHOLIN4YL)2(3METHYL4NITROPYRAZOL1YL)PROPAN1ONE
1024272476
CC1CN(CC(O1)C)C(=O)C(C)N2C=C(C(=N2)C)(N+)(=O)(O)
CC1OC(C)CN(C1)C(=O)C(n1nc(c(c1)(N+)(=O)(O))C)C
InChI=1SC13H20N4O4c18515(69(2)218)13(18)11(4)16712(17(19)20)10(3)1416h7911H56H214H3
MFCD04044188
ZINC000002771151
ZINC000018129219

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Available files

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