Vitas-M small molecule compound

(4-tert-butylphenyl)[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]methanone

Catalog ID
STK148971
SMILES O=C(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1c(Cl)cccc1[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 C21H24ClN3O3 MW 401.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O3/c1-21(2,3)16-9-7-15(8-10-16)20(26)24-13-11-23(12-14-24)19-17(22)5-4-6-18(19)25(27)28/h4-10H,11-14H2,1-3H3
InChIKey
GJEVTCLSAKZALE-UHFFFAOYSA-N
Synonyms

(4TERTBUTYLPHENYL)(4(2CHLORO6NITROPHENYL)PIPERAZIN1YL)METHANONE
4(TERTBUTYL)PHENYL4(6CHLORO2NITROPHENYL)PIPERAZINYLKETONE
CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)(N+)(=O)(O)
InChI=1SC21H24ClN3O3c121(23)169715(81016)20(26)24131123(121424)1917(22)54618(19)25(27)28h410H1114H213H3
MFCD02632045
O=C(c1ccc(cc1)C(C)(C)C)N1CCN(CC1)c1c(Cl)cccc1(N+)(=O)(O)
ZINC000004575245
ZINC04575245
ZINC4575245

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Available files

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