Vitas-M small molecule compound

{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(3-ethoxyphenyl)methanone

Catalog ID
STL023863
SMILES CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)[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 C26H28N4O4 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4/c1-2-34-23-10-6-9-21(17-23)26(31)29-15-13-28(14-16-29)22-11-12-25(30(32)33)24(18-22)27-19-20-7-4-3-5-8-20/h3-12,17-18,27H,2,13-16,19H2,1H3
InChIKey
RRDJAOBBPRSLHZ-UHFFFAOYSA-N
Synonyms
591736-20-8
(4(3(benzylamino)4nitrophenyl)piperazin1yl)(3ethoxyphenyl)methanone
591736208
CCOC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4
CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)(N+)(=O)(O)
InChI=1SC26H28N4O4c123423106921(1723)26(31)29151328(141629)22111225(30(32)33)24(1822)2719207435820h312171827H2131619H21H3
MFCD03688141
ZINC000009046504
ZINC09046504
ZINC9046504

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Available files

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