Vitas-M small molecule compound

11-(4-methoxyphenyl)-3-(3-nitrophenyl)-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STL169450
SMILES COc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccc(c2)[N+](=O)[O-])Nc2c(N1C(=O)CC)cccc2

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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 C29H27N3O5 MW 497.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O5/c1-3-27(34)31-25-10-5-4-9-23(25)30-24-16-20(19-7-6-8-21(15-19)32(35)36)17-26(33)28(24)29(31)18-11-13-22(37-2)14-12-18/h4-15,20,29-30H,3,16-17H2,1-2H3
InChIKey
MOJLGQKCXIBHQU-UHFFFAOYSA-N
Synonyms
362000-89-3
11(4methoxyphenyl)3(3nitrophenyl)10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4methoxyphenyl)3(3nitrophenyl)10propionyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
362000893
6(4methoxyphenyl)9(3nitrophenyl)5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC(=CC=C3)(N+)(=O)(O))NC4=CC=CC=C41)C5=CC=C(C=C5)OC
COc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccc(c2)(N+)(=O)(O))Nc2c(N1C(=O)CC)cccc2
InChI=1SC29H27N3O5c1327(34)31251054923(25)30241620(1976821(1519)32(35)36)1726(33)28(24)29(31)18111322(372)141218h415202930H31617H212H3
MFCD01949209
ZINC000009236825
ZINC000009236840

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Available files

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