Vitas-M small molecule compound
3-tert-butyl-N-(2-hydroxyethyl)-N,1-dimethyl-4-nitro-1H-pyrazole-5-carboxamide
Catalog ID
STK535162
SMILES OCCN(C(=O)c1n(C)nc(c1[N+](=O)[O-])C(C)(C)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 C12H20N4O4 MW 284.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H20N4O4/c1-12(2,3)10-8(16(19)20)9(15(5)13-10)11(18)14(4)6-7-17/h17H,6-7H2,1-5H3InChIKey
XCARYOSOOIICKX-UHFFFAOYSA-NSynonyms
3(tertbutyl)N(2hydroxyethyl)N1dimethyl4nitro1Hpyrazole5carboxamide
3tertbutylN(2hydroxyethyl)N1dimethyl4nitro1Hpyrazole5carboxamide
5TERTBUTYLN(2HYDROXYETHYL)N2DIMETHYL4NITROPYRAZOLE3CARBOXAMIDE
CC(C)(C)C1=NN(C(=C1(N+)(=O)(O))C(=O)N(C)CCO)C
InChI=1SC12H20N4O4c112(23)108(16(19)20)9(15(5)1310)11(18)14(4)6717h17H67H215H3
MFCD02163185
OCCN(C(=O)c1n(C)nc(c1(N+)(=O)(O))C(C)(C)C)C
ZINC000004834204
ZINC04834204
ZINC4834204
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