Vitas-M small molecule compound

(4-tert-butylphenyl)(4-{4-nitro-3-[(tetrahydrofuran-2-ylmethyl)amino]phenyl}piperazin-1-yl)methanone

Catalog ID
STK157824
SMILES O=C(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)NCC1CCCO1)[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 C26H34N4O4 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4O4/c1-26(2,3)20-8-6-19(7-9-20)25(31)29-14-12-28(13-15-29)21-10-11-24(30(32)33)23(17-21)27-18-22-5-4-16-34-22/h6-11,17,22,27H,4-5,12-16,18H2,1-3H3
InChIKey
MHUDJEOFOZZAFT-UHFFFAOYSA-N
Synonyms
591736-98-0
(4(tertbutyl)phenyl)(4(4nitro3(((tetrahydrofuran2yl)methyl)amino)phenyl)piperazin1yl)methanone
(4TERTBUTYLPHENYL)(4(4NITRO3((TETRAHYDROFURAN2YLMETHYL)AMINO)PHENYL)PIPERAZIN1YL)METHANONE
(4TERTBUTYLPHENYL)(4(4NITRO3(OXOLAN2YLMETHYLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
591736980
CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4CCCO4
InChI=1SC26H34N4O4c126(23)208619(7920)25(31)29141228(131529)21101124(30(32)33)23(1721)27182254163422h611172227H45121618H213H3
MFCD03689532
ZINC000009236561
ZINC000009236568

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Available files

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