Vitas-M small molecule compound

2-(4-tert-butylphenoxy)-1-{4-[3-(cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}ethanone

Catalog ID
STK028760
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)NC1CC1)[N+](=O)[O-])COc1ccc(cc1)C(C)(C)C

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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 C25H32N4O4 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O4/c1-25(2,3)18-4-9-21(10-5-18)33-17-24(30)28-14-12-27(13-15-28)20-8-11-23(29(31)32)22(16-20)26-19-6-7-19/h4-5,8-11,16,19,26H,6-7,12-15,17H2,1-3H3
InChIKey
ULRARJXDKUJHHF-UHFFFAOYSA-N
Synonyms

1((4TERTBUTYLPHENOXY)ACETYL)4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZINE
2(4(tertbutyl)phenoxy)1(4(3(cyclopropylamino)4nitrophenyl)piperazin1yl)ethanone
2(4(TERTBUTYL)PHENOXY)1(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
2(4TERTBUTYLPHENOXY)1(4(3(CYCLOPROPYLAMINO)4NITROPHENYL)PIPERAZIN1YL)ETHANONE
CC(C)(C)C1=CC=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NC4CC4
InChI=1SC25H32N4O4c125(23)184921(10518)331724(30)28141227(131528)2081123(29(31)32)22(1620)26196719h45811161926H67121517H213H3
MFCD02627829
O=C(N1CCN(CC1)c1ccc(c(c1)NC1CC1)(N+)(=O)(O))COc1ccc(cc1)C(C)(C)C
STK028760
ZINC000008385723
ZINC08385723
ZINC8385723

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Available files

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