Vitas-M small molecule compound
ethyl 4-({4-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)piperazine-1-carboxylate
Catalog ID
STL395353
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)Cn1cc(c(n1)[N+](=O)[O-])Cl
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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 C18H20ClN5O5 MW 421.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN5O5/c1-2-29-18(26)22-9-7-21(8-10-22)17(25)14-5-3-13(4-6-14)11-23-12-15(19)16(20-23)24(27)28/h3-6,12H,2,7-11H2,1H3InChIKey
XFRJNZRSVUCMPY-UHFFFAOYSA-NSynonyms
1005621-58-81005621588
CCOC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)Cn1cc(c(n1)(N+)(=O)(O))Cl
CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3C=C(C(=N3)(N+)(=O)(O))Cl
ETHYL4((4((4CHLORO3NITRO1HPYRAZOL1YL)METHYL)PHENYL)CARBONYL)PIPERAZINE1CARBOXYLATE
ethyl4(4((4chloro3nitropyrazol1yl)methyl)benzoyl)piperazine1carboxylate
InChI=1SC18H20ClN5O5c122918(26)229721(81022)17(25)145313(4614)11231215(19)16(2023)24(27)28h3612H2711H21H3
MFCD04138034
ZINC000002809523
ZINC02809523
ZINC2809523
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