Vitas-M small molecule compound
{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}(2-methoxy-3-methylphenyl)methanone
Catalog ID
STK198646
SMILES COc1c(C)cccc1C(=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 C28H30N4O4 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4/c1-20-6-5-9-24(27(20)36-2)28(33)30-16-14-29(15-17-30)23-10-11-25(32(34)35)26(18-23)31-13-12-21-7-3-4-8-22(21)19-31/h3-11,18H,12-17,19H2,1-2H3InChIKey
YROXCVPIQNTSKJ-UHFFFAOYSA-NSynonyms
(4(3(34DIHYDRO1HISOQUINOLIN2YL)4NITROPHENYL)PIPERAZIN1YL)(2METHOXY3METHYLPHENYL)METHANONE
(4(3(34DIHYDROISOQUINOLIN2(1H)YL)4NITROPHENYL)PIPERAZIN1YL)(2METHOXY3METHYLPHENYL)METHANONE
CC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4CCC5=CC=CC=C5C4
COc1c(C)cccc1C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC28H30N4O4c12065924(27(20)362)28(33)30161429(151730)23101125(32(34)35)26(1823)31131221734822(21)1931h31118H121719H212H3
MFCD05826415
ZINC000009934610
ZINC09934610
ZINC9934610
Check stock
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Check stock on Vitas-MAvailable files
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