Vitas-M small molecule compound
{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}(3-methylphenyl)methanone
Catalog ID
STK154785
SMILES Cc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[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 C27H28N4O3 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3/c1-20-5-4-8-22(17-20)27(32)29-15-13-28(14-16-29)24-9-10-25(31(33)34)26(18-24)30-12-11-21-6-2-3-7-23(21)19-30/h2-10,17-18H,11-16,19H2,1H3InChIKey
CIZXPEKJUDEVAN-UHFFFAOYSA-NSynonyms
597545-64-7(4(3(34DIHYDRO1HISOQUINOLIN2YL)4NITROPHENYL)PIPERAZIN1YL)(3METHYLPHENYL)METHANONE
(4(3(34DIHYDROISOQUINOLIN2(1H)YL)4NITROPHENYL)PIPERAZIN1YL)(3METHYLPHENYL)METHANONE
(4(3(34dihydroisoquinolin2(1H)yl)4nitrophenyl)piperazin1yl)(mtolyl)methanone
597545647
CC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCC5=CC=CC=C5C4
Cc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC27H28N4O3c12054822(1720)27(32)29151328(141629)2491025(31(33)34)26(1824)30121121623723(21)1930h2101718H111619H21H3
MFCD03923671
ZINC000009191553
ZINC09191553
ZINC9191553
Check stock
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Check stock on Vitas-MAvailable files
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