Vitas-M small molecule compound
1-{4-[3-(benzylamino)-4-nitrophenyl]piperazin-1-yl}-2-(4-methylphenoxy)ethanone
Catalog ID
STK093185
SMILES Cc1ccc(cc1)OCC(=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/c1-20-7-10-23(11-8-20)34-19-26(31)29-15-13-28(14-16-29)22-9-12-25(30(32)33)24(17-22)27-18-21-5-3-2-4-6-21/h2-12,17,27H,13-16,18-19H2,1H3InChIKey
RDFKBSOFIGLLBQ-UHFFFAOYSA-NSynonyms
1(3(BENZYLAMINO)4NITROPHENYL)4((4METHYLPHENOXY)ACETYL)PIPERAZINE
1(4(3(BENZYLAMINO)4NITROPHENYL)PIPERAZIN1YL)2(4METHYLPHENOXY)ETHANONE
1(4(3(benzylamino)4nitrophenyl)piperazin1yl)2(ptolyloxy)ethanone
CC1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CC=C4
Cc1ccc(cc1)OCC(=O)N1CCN(CC1)c1ccc(c(c1)NCc1ccccc1)(N+)(=O)(O)
InChI=1SC26H28N4O4c12071023(11820)341926(31)29151328(141629)2291225(30(32)33)24(1722)2718215324621h2121727H13161819H21H3
MFCD02627828
STK093185
ZINC000008385719
ZINC08385719
ZINC8385719
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