Vitas-M small molecule compound

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

Catalog ID
STK148893
SMILES [O-][N+](=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)C(=O)c1ccccc1C

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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/c1-20-7-5-6-10-23(20)26(31)29-17-15-28(16-18-29)22-11-12-25(30(32)33)24(19-22)27-14-13-21-8-3-2-4-9-21/h2-12,19,27H,13-18H2,1H3
InChIKey
OIEVJSMBVHMSNO-UHFFFAOYSA-N
Synonyms

(2METHYLPHENYL)(4(4NITRO3((2PHENYLETHYL)AMINO)PHENYL)PIPERAZIN1YL)METHANONE
(2methylphenyl)(4(4nitro3(2phenylethylamino)phenyl)piperazin1yl)methanone
(2METHYLPHENYL)(4(4NITRO3(PHENETHYLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
(O)(N+)(=O)c1ccc(cc1NCCc1ccccc1)N1CCN(CC1)C(=O)c1ccccc1C
CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCCC4=CC=CC=C4
InChI=1SC26H28N4O3c1207561023(20)26(31)29171528(161829)22111225(30(32)33)24(1922)271413218324921h2121927H1318H21H3
MFCD02631956
ZINC000009601741
ZINC09601741
ZINC9601741

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Available files

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