Vitas-M small molecule compound

1-(4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)-2-phenylethanone

Catalog ID
STK157741
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)NCCc1ccccc1)[N+](=O)[O-])Cc1ccccc1

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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 C26H28N4O3 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3/c31-26(19-22-9-5-2-6-10-22)29-17-15-28(16-18-29)23-11-12-25(30(32)33)24(20-23)27-14-13-21-7-3-1-4-8-21/h1-12,20,27H,13-19H2
InChIKey
MLGHBDYMBPDSRT-UHFFFAOYSA-N
Synonyms
591736-22-0
1(4(4NITRO3((2PHENYLETHYL)AMINO)PHENYL)PIPERAZIN1YL)2PHENYLETHANONE
1(4(4nitro3(2phenylethylamino)phenyl)piperazin1yl)2phenylethanone
1(4(4NITRO3(PHENETHYLAMINO)PHENYL)PIPERAZIN1YL)2PHENYLETHANONE
591736220
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCCC3=CC=CC=C3)C(=O)CC4=CC=CC=C4
InChI=1SC26H28N4O3c3126(192295261022)29171528(161829)23111225(30(32)33)24(2023)271413217314821h1122027H1319H2
MFCD03691610
O=C(N1CCN(CC1)c1ccc(c(c1)NCCc1ccccc1)(N+)(=O)(O))Cc1ccccc1
ZINC000009194582
ZINC09194582
ZINC9194582

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Available files

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