Vitas-M small molecule compound
{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}(2-methoxyphenyl)methanone
Catalog ID
STK043607
SMILES COc1ccccc1C(=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 C25H26N4O4 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4/c1-33-24-10-6-5-9-21(24)25(30)28-15-13-27(14-16-28)20-11-12-23(29(31)32)22(17-20)26-18-19-7-3-2-4-8-19/h2-12,17,26H,13-16,18H2,1H3InChIKey
SVGPTIDKLHAFHX-UHFFFAOYSA-NSynonyms
(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(2METHOXYPHENYL)METHANONE
2METHOXYPHENYL4(4NITRO3(BENZYLAMINO)PHENYL)PIPERAZINYLKETONE
COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4
COc1ccccc1C(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)(N+)(=O)(O)
InChI=1SC25H26N4O4c133241065921(24)25(30)28151327(141628)20111223(29(31)32)22(1720)2618197324819h2121726H131618H21H3
MFCD02627834
STK043607
ZINC000009008792
ZINC09008792
ZINC9008792
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