Vitas-M small molecule compound
1-{4-[3-(ethylamino)-4-nitrophenyl]piperazin-1-yl}-2,2-dimethylpropan-1-one
Catalog ID
STK172390
SMILES CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)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 C17H26N4O3 MW 334.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H26N4O3/c1-5-18-14-12-13(6-7-15(14)21(23)24)19-8-10-20(11-9-19)16(22)17(2,3)4/h6-7,12,18H,5,8-11H2,1-4H3InChIKey
OOKXRBXURMVMDT-UHFFFAOYSA-NSynonyms
1(4(3(ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)22DIMETHYLPROPAN1ONE
CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C(C)(C)C)(N+)(=O)(O)
CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)C(C)(C)C
InChI=1SC17H26N4O3c1518141213(6715(14)21(23)24)1981020(11919)16(22)17(23)4h671218H5811H214H3
MFCD04405536
ZINC000004703749
ZINC04703749
ZINC4703749
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