Vitas-M small molecule compound
3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-1-(morpholin-4-yl)propan-1-one
Catalog ID
STL393038
SMILES O=C(N1CCOCC1)CCn1nc(c(c1C)[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 C12H18N4O4 MW 282.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O4/c1-9-12(16(18)19)10(2)15(13-9)4-3-11(17)14-5-7-20-8-6-14/h3-8H2,1-2H3InChIKey
ZJBVACOBQBOALQ-UHFFFAOYSA-NSynonyms
1005705-56-51005705565
3(35DIMETHYL4NITRO1HPYRAZOL1YL)1(MORPHOLIN4YL)PROPAN1ONE
3(35dimethyl4nitropyrazol1yl)1morpholin4ylpropan1one
CC1=C(C(=NN1CCC(=O)N2CCOCC2)C)(N+)(=O)(O)
InChI=1SC12H18N4O4c1912(16(18)19)10(2)15(139)4311(17)1457208614h38H212H3
MFCD04044601
O=C(N1CCOCC1)CCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000002778458
ZINC02778458
ZINC2778458
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