Vitas-M small molecule compound
{4-[4-fluoro-2-nitro-5-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}(3-fluorophenyl)methanone
Catalog ID
STK762632
SMILES Fc1cccc(c1)C(=O)N1CCN(CC1)c1cc(N2CCCC2)c(cc1[N+](=O)[O-])F
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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 C21H22F2N4O3 MW 416.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F2N4O3/c22-16-5-3-4-15(12-16)21(28)26-10-8-25(9-11-26)19-14-18(24-6-1-2-7-24)17(23)13-20(19)27(29)30/h3-5,12-14H,1-2,6-11H2InChIKey
RXRGXQWLGAJNSN-UHFFFAOYSA-NSynonyms
(4(4fluoro2nitro5(pyrrolidin1yl)phenyl)piperazin1yl)(3fluorophenyl)methanone
(4(4FLUORO2NITRO5PYRROLIDIN1YLPHENYL)PIPERAZIN1YL)(3FLUOROPHENYL)METHANONE
4(4FLUORO2NITRO5PYRROLIDINYLPHENYL)PIPERAZINYL3FLUOROPHENYLKETONE
C1CCN(C1)C2=C(C=C(C(=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)F)(N+)(=O)(O))F
Fc1cccc(c1)C(=O)N1CCN(CC1)c1cc(N2CCCC2)c(cc1(N+)(=O)(O))F
InChI=1SC21H22F2N4O3c221653415(1216)21(28)2610825(91126)191418(24612724)17(23)1320(19)27(29)30h351214H12611H2
MFCD01872346
ZINC000004499185
ZINC04499185
ZINC4499185
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