Vitas-M small molecule compound

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

Catalog ID
STK206423
SMILES O=C(c1ccc(c(c1)Cl)C)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 C23H27ClN4O3 MW 442.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN4O3/c1-17-5-6-18(15-20(17)24)23(29)27-13-11-25(12-14-27)19-7-8-21(28(30)31)22(16-19)26-9-3-2-4-10-26/h5-8,15-16H,2-4,9-14H2,1H3
InChIKey
PSFXTHOTTXGERE-UHFFFAOYSA-N
Synonyms

(3CHLORO4METHYLPHENYL)(4(4NITRO3(PIPERIDIN1YL)PHENYL)PIPERAZIN1YL)METHANONE
(3CHLORO4METHYLPHENYL)(4(4NITRO3PIPERIDIN1YLPHENYL)PIPERAZIN1YL)METHANONE
CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCCCC4)Cl
InChI=1SC23H27ClN4O3c1175618(1520(17)24)23(29)27131125(121427)197821(28(30)31)22(1619)2693241026h581516H24914H21H3
MFCD05829470
O=C(c1ccc(c(c1)Cl)C)N1CCN(CC1)c1ccc(c(c1)N1CCCCC1)(N+)(=O)(O)
ZINC000009972108
ZINC09972108
ZINC9972108

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Available files

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