Vitas-M small molecule compound

(3,4-dimethoxyphenyl){4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl}methanone

Catalog ID
STK172030
SMILES COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc(c(c1)NC)[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 C20H24N4O5 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O5/c1-21-16-13-15(5-6-17(16)24(26)27)22-8-10-23(11-9-22)20(25)14-4-7-18(28-2)19(12-14)29-3/h4-7,12-13,21H,8-11H2,1-3H3
InChIKey
KICWFOUYOSAZHM-UHFFFAOYSA-N
Synonyms

(34DIMETHOXYPHENYL)(4(3(METHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
34DIMETHOXYPHENYL4(3(METHYLAMINO)4NITROPHENYL)PIPERAZINYLKETONE
CNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC)(N+)(=O)(O)
COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc(c(c1)NC)(N+)(=O)(O)
InChI=1SC20H24N4O5c121161315(5617(16)24(26)27)2281023(11922)20(25)144718(282)19(1214)293h47121321H811H213H3
MFCD05661668
ZINC000004125044
ZINC04125044
ZINC4125044

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Available files

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