Vitas-M small molecule compound
1-benzofuran-2-yl{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}methanone
Catalog ID
STK198647
SMILES [O-][N+](=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)C(=O)c1cc2c(o1)cccc2
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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 C26H24N4O4 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O4/c31-26(25-16-20-8-4-5-9-24(20)34-25)29-14-12-28(13-15-29)21-10-11-23(30(32)33)22(17-21)27-18-19-6-2-1-3-7-19/h1-11,16-17,27H,12-15,18H2InChIKey
FSUQAUFQVZMQNV-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1NCc1ccccc1)N1CCN(CC1)C(=O)c1cc2c(o1)cccc2
1BENZOFURAN2YL(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCC3=CC=CC=C3)C(=O)C4=CC5=CC=CC=C5O4
InChI=1SC26H24N4O4c3126(251620845924(20)3425)29141228(131529)21101123(30(32)33)22(1721)2718196213719h111161727H121518H2
MFCD05826416
ZINC000009934611
ZINC09934611
ZINC9934611
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