Vitas-M small molecule compound
1-(1-benzyl-5-methoxy-2-methyl-1H-indol-3-yl)-2-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
Catalog ID
STK552757
SMILES COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])c(n2Cc1ccccc1)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 C29H30N4O4 MW 498.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O4/c1-21-29(26-18-25(37-2)12-13-27(26)32(21)19-22-6-4-3-5-7-22)28(34)20-30-14-16-31(17-15-30)23-8-10-24(11-9-23)33(35)36/h3-13,18H,14-17,19-20H2,1-2H3InChIKey
FRPBPRMWLAUPRK-UHFFFAOYSA-NSynonyms
836651-14-01(1benzyl5methoxy2methyl1Hindol3yl)2(4(4nitrophenyl)piperazin1yl)ethanone
1(1BENZYL5METHOXY2METHYLINDOL3YL)2(4(4NITROPHENYL)PIPERAZIN1YL)ETHANONE
836651140
CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC)C(=O)CN4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))c(n2Cc1ccccc1)C
InChI=1SC29H30N4O4c12129(261825(372)121327(26)32(21)19226435722)28(34)2030141631(171530)2381024(11923)33(35)36h31318H14171920H212H3
MFCD03692265
ZINC000036186916
ZINC36186916
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