Vitas-M small molecule compound

(4-chloro-3-nitrophenyl){4-[4-nitro-3-(piperidin-1-yl)phenyl]piperazin-1-yl}methanone

Catalog ID
STK355542
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])Cl)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)[N+](=O)[O-]

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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 C22H24ClN5O5 MW 473.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN5O5/c23-18-6-4-16(14-20(18)28(32)33)22(29)26-12-10-24(11-13-26)17-5-7-19(27(30)31)21(15-17)25-8-2-1-3-9-25/h4-7,14-15H,1-3,8-13H2
InChIKey
WWIWPDUIGWNLBH-UHFFFAOYSA-N
Synonyms

(4chloro3nitrophenyl)(4(4nitro3(piperidin1yl)phenyl)piperazin1yl)methanone
(4CHLORO3NITROPHENYL)(4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZIN1YL)METHANONE
1((4CHLORO3NITROPHENYL)CARBONYL)4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZINE
4CHLORO3NITROPHENYL4(4NITRO3PIPERIDYLPHENYL)PIPERAZINYLKETONE
C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC22H24ClN5O5c23186416(1420(18)28(32)33)22(29)26121024(111326)175719(27(30)31)21(1517)258213925h471415H13813H2
MFCD07628347
O=C(c1ccc(c(c1)(N+)(=O)(O))Cl)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)(N+)(=O)(O)
ZINC000004125292
ZINC04125292
ZINC4125292

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Available files

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