Vitas-M small molecule compound

1,5-dimethyl-4-nitro-N-[1-(tetrahydrofuran-2-yl)ethyl]-1H-pyrazole-3-carboxamide

Catalog ID
STK303546
SMILES CC(C1CCCO1)NC(=O)c1nn(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 C12H18N4O4 MW 282.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N4O4/c1-7(9-5-4-6-20-9)13-12(17)10-11(16(18)19)8(2)15(3)14-10/h7,9H,4-6H2,1-3H3,(H,13,17)
InChIKey
DTRCNBHBUAMMKH-UHFFFAOYSA-N
Synonyms
1005703-77-4
1005703774
15DIMETHYL4NITRON(1(OXOLAN2YL)ETHYL)PYRAZOLE3CARBOXAMIDE
15dimethyl4nitroN(1(tetrahydrofuran2yl)ethyl)1Hpyrazole3carboxamide
CC(C1CCCO1)NC(=O)c1nn(c(c1(N+)(=O)(O))C)C
CC1=C(C(=NN1C)C(=O)NC(C)C2CCCO2)(N+)(=O)(O)
InChI=1SC12H18N4O4c17(9546209)1312(17)1011(16(18)19)8(2)15(3)1410h79H46H213H3(H1317)
MFCD04043611
ZINC000002777702
ZINC000002777705

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.