Vitas-M small molecule compound
2-(4-chloro-3-methylphenoxy)-1-{4-[3-(morpholin-4-yl)-4-nitrophenyl]piperazin-1-yl}ethanone
Catalog ID
STK216628
SMILES O=C(N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)[N+](=O)[O-])COc1ccc(c(c1)C)Cl
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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 C23H27ClN4O5 MW 474.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN4O5/c1-17-14-19(3-4-20(17)24)33-16-23(29)27-8-6-25(7-9-27)18-2-5-21(28(30)31)22(15-18)26-10-12-32-13-11-26/h2-5,14-15H,6-13,16H2,1H3InChIKey
KDUKHSRMFTTXDL-UHFFFAOYSA-NSynonyms
2(4CHLORO3METHYLPHENOXY)1(4(3(MORPHOLIN4YL)4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2(4CHLORO3METHYLPHENOXY)1(4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZIN1YL)ETHANONE
2(4CHLORO3METHYLPHENOXY)1(4(3MORPHOLIN4YL4NITROPHENYL)PIPERAZINYL)ETHAN1ONE
CC1=C(C=CC(=C1)OCC(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCOCC4)Cl
InChI=1SC23H27ClN4O5c1171419(3420(17)24)331623(29)278625(7927)182521(28(30)31)22(1518)26101232131126h251415H61316H21H3
MFCD07363199
O=C(N1CCN(CC1)c1ccc(c(c1)N1CCOCC1)(N+)(=O)(O))COc1ccc(c(c1)C)Cl
ZINC000004125263
ZINC04125263
ZINC4125263
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