Vitas-M small molecule compound
N-[1-(3,4-diethoxybenzyl)-1H-pyrazol-4-yl]-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STL398407
SMILES CCOc1cc(ccc1OCC)Cn1ncc(c1)NC(=O)c1nn(cc1[N+](=O)[O-])CC
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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 C20H24N6O5 MW 428.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N6O5/c1-4-24-13-16(26(28)29)19(23-24)20(27)22-15-10-21-25(12-15)11-14-7-8-17(30-5-2)18(9-14)31-6-3/h7-10,12-13H,4-6,11H2,1-3H3,(H,22,27)InChIKey
JUYJKHVITPWDDY-UHFFFAOYSA-NSynonyms
1005582-88-61005582886
CCN1C=C(C(=N1)C(=O)NC2=CN(N=C2)CC3=CC(=C(C=C3)OCC)OCC)(N+)(=O)(O)
CCOc1cc(ccc1OCC)Cn1ncc(c1)NC(=O)c1nn(cc1(N+)(=O)(O))CC
InChI=1SC20H24N6O5c14241316(26(28)29)19(2324)20(27)2215102125(1215)11147817(3052)18(914)3163h7101213H4611H213H3(H2227)
MFCD04050396
N(1((34DIETHOXYPHENYL)METHYL)PYRAZOL4YL)1ETHYL4NITROPYRAZOLE3CARBOXAMIDE
N(1(34DIETHOXYBENZYL)1HPYRAZOL4YL)1ETHYL4NITRO1HPYRAZOLE3CARBOXAMIDE
ZINC000002785096
ZINC02785096
ZINC2785096
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