Vitas-M small molecule compound
(4-tert-butylphenyl)[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone
Catalog ID
STK172396
SMILES COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccc(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 C22H27N3O4 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O4/c1-22(2,3)17-7-5-16(6-8-17)21(26)24-13-11-23(12-14-24)19-10-9-18(29-4)15-20(19)25(27)28/h5-10,15H,11-14H2,1-4H3InChIKey
QQAYCGXQSZJAIT-UHFFFAOYSA-NSynonyms
(4TERTBUTYLPHENYL)(4(4METHOXY2NITROPHENYL)PIPERAZIN1YL)METHANONE
CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)OC)(N+)(=O)(O)
COc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccc(cc1)C(C)(C)C
InChI=1SC22H27N3O4c122(23)177516(6817)21(26)24131123(121424)1910918(294)1520(19)25(27)28h51015H1114H214H3
MFCD04219013
ZINC000004703752
ZINC04703752
ZINC4703752
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