Vitas-M small molecule compound

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

Catalog ID
STK741918
SMILES CCC(=O)N1c2ccccc2NC2=C(C1c1ccc(cc1)C)C(=O)CC(C2)c1ccccc1

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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 C29H28N2O2 MW 436.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N2O2/c1-3-27(33)31-25-12-8-7-11-23(25)30-24-17-22(20-9-5-4-6-10-20)18-26(32)28(24)29(31)21-15-13-19(2)14-16-21/h4-16,22,29-30H,3,17-18H2,1-2H3
InChIKey
XXOXHKPAFDFNLX-UHFFFAOYSA-N
Synonyms
354539-32-5
11(4methylphenyl)3phenyl10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
354539325
3phenyl10propionyl11(ptolyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4methylphenyl)9phenyl5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC4=CC=CC=C41)C5=CC=C(C=C5)C
InChI=1SC29H28N2O2c1327(33)312512871123(25)30241722(2095461020)1826(32)28(24)29(31)21151319(2)141621h416222930H31718H212H3
MFCD01946978
ZINC000008995745
ZINC000017043881

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Available files

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