Vitas-M small molecule compound

(4-tert-butylphenyl){4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazin-1-yl}methanone

Catalog ID
STK154767
SMILES O=C(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)[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 C25H32N4O3 MW 436.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O3/c1-25(2,3)20-8-6-19(7-9-20)24(30)28-16-14-26(15-17-28)21-10-11-22(29(31)32)23(18-21)27-12-4-5-13-27/h6-11,18H,4-5,12-17H2,1-3H3
InChIKey
TUPUIJNXEMBRDD-UHFFFAOYSA-N
Synonyms
593237-97-9
(4(tertbutyl)phenyl)(4(4nitro3(pyrrolidin1yl)phenyl)piperazin1yl)methanone
(4TERTBUTYLPHENYL)(4(4NITRO3(PYRROLIDIN1YL)PHENYL)PIPERAZIN1YL)METHANONE
(4TERTBUTYLPHENYL)(4(4NITRO3PYRROLIDIN1YLPHENYL)PIPERAZIN1YL)METHANONE
593237979
CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCCC4
InChI=1SC25H32N4O3c125(23)208619(7920)24(30)28161426(151728)21101122(29(31)32)23(1821)2712451327h61118H451217H213H3
MFCD03686293
O=C(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1ccc(c(c1)N1CCCC1)(N+)(=O)(O)
ZINC000009271751
ZINC09271751
ZINC9271751

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Available files

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