Vitas-M small molecule compound
ethyl 4-({2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)piperazine-1-carboxylate
Catalog ID
STL396577
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccccc1Cn1nc(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 C20H25N5O5 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N5O5/c1-4-30-20(27)23-11-9-22(10-12-23)19(26)17-8-6-5-7-16(17)13-24-15(3)18(25(28)29)14(2)21-24/h5-8H,4,9-13H2,1-3H3InChIKey
XQLLQQKDNQRMBQ-UHFFFAOYSA-NSynonyms
1005652-82-31005652823
CCOC(=O)N1CCN(CC1)C(=O)c1ccccc1Cn1nc(c(c1C)(N+)(=O)(O))C
CCOC(=O)N1CCN(CC1)C(=O)C2=CC=CC=C2CN3C(=C(C(=N3)C)(N+)(=O)(O))C
ETHYL4((2((35DIMETHYL4NITRO1HPYRAZOL1YL)METHYL)PHENYL)CARBONYL)PIPERAZINE1CARBOXYLATE
ETHYL4(2((35DIMETHYL4NITROPYRAZOL1YL)METHYL)BENZOYL)PIPERAZINE1CARBOXYLATE
InChI=1SC20H25N5O5c143020(27)2311922(101223)19(26)17865716(17)132415(3)18(25(28)29)14(2)2124h58H4913H213H3
MFCD04051187
ZINC000002795297
ZINC02795297
ZINC2795297
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