Vitas-M small molecule compound

(3-chloro-4-methylphenyl){4-[3-(ethylamino)-4-nitrophenyl]piperazin-1-yl}methanone

Catalog ID
STK205875
SMILES CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccc(c(c1)Cl)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 C20H23ClN4O3 MW 402.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23ClN4O3/c1-3-22-18-13-16(6-7-19(18)25(27)28)23-8-10-24(11-9-23)20(26)15-5-4-14(2)17(21)12-15/h4-7,12-13,22H,3,8-11H2,1-2H3
InChIKey
FRPHOGMLGFBARB-UHFFFAOYSA-N
Synonyms

(3CHLORO4METHYLPHENYL)(4(3(ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)C)Cl)(N+)(=O)(O)
CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccc(c(c1)Cl)C
InChI=1SC20H23ClN4O3c1322181316(6719(18)25(27)28)2381024(11923)20(26)155414(2)17(21)1215h47121322H3811H212H3
MFCD05838546
ZINC000004740898
ZINC04740898
ZINC4740898

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Available files

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