Vitas-M small molecule compound
1-[4-(2-chloro-4-fluorobenzyl)piperazin-1-yl]-3-(4-chloro-3-nitro-1H-pyrazol-1-yl)propan-1-one
Catalog ID
STL401699
SMILES Fc1ccc(c(c1)Cl)CN1CCN(CC1)C(=O)CCn1cc(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 C17H18Cl2FN5O3 MW 430.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18Cl2FN5O3/c18-14-9-13(20)2-1-12(14)10-22-5-7-23(8-6-22)16(26)3-4-24-11-15(19)17(21-24)25(27)28/h1-2,9,11H,3-8,10H2InChIKey
SEKYMFZJQAPBQF-UHFFFAOYSA-NSynonyms
1005575-98-31(4((2chloro4fluorophenyl)methyl)piperazin1yl)3(4chloro3nitropyrazol1yl)propan1one
1(4(2chloro4fluorobenzyl)piperazin1yl)3(4chloro3nitro1Hpyrazol1yl)propan1one
1005575983
C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C(=O)CCN3C=C(C(=N3)(N+)(=O)(O))Cl
Fc1ccc(c(c1)Cl)CN1CCN(CC1)C(=O)CCn1cc(c(n1)(N+)(=O)(O))Cl
InChI=1SC17H18Cl2FN5O3c1814913(20)2112(14)10225723(8622)16(26)34241115(19)17(2124)25(27)28h12911H3810H2
MFCD04140377
ZINC000022485894
ZINC22485894
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