Vitas-M small molecule compound
{4-[3-(ethylamino)-4-nitrophenyl]piperazin-1-yl}(furan-2-yl)methanone
Catalog ID
STK171994
SMILES CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccco1
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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 C17H20N4O4 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O4/c1-2-18-14-12-13(5-6-15(14)21(23)24)19-7-9-20(10-8-19)17(22)16-4-3-11-25-16/h3-6,11-12,18H,2,7-10H2,1H3InChIKey
KGHDFKXDUOQDDX-UHFFFAOYSA-NSynonyms
(4(3(ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(FURAN2YL)METHANONE
CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=CO3)(N+)(=O)(O)
CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccco1
InChI=1SC17H20N4O4c1218141213(5615(14)21(23)24)197920(10819)17(22)1643112516h36111218H2710H21H3
MFCD05794957
ZINC000004703658
ZINC04703658
ZINC4703658
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