Vitas-M small molecule compound

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

Catalog ID
STK038294
SMILES O=C1CC(CC2=C1C(c1ccc(cc1)[N+](=O)[O-])N(c1c(N2)cccc1)C(=O)c1ccccc1)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 C32H25N3O4 MW 515.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25N3O4/c36-29-20-24(21-9-3-1-4-10-21)19-27-30(29)31(22-15-17-25(18-16-22)35(38)39)34(28-14-8-7-13-26(28)33-27)32(37)23-11-5-2-6-12-23/h1-18,24,31,33H,19-20H2
InChIKey
WGVUHSVAFYEZBA-UHFFFAOYSA-N
Synonyms

11(4nitrophenyl)3phenyl10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5benzoyl6(4nitrophenyl)9phenyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC32H25N3O4c36292024(2193141021)192730(29)31(22151725(181622)35(38)39)34(2814871326(28)3327)32(37)23115261223h118243133H1920H2
MFCD02634116
O=C1CC(CC2=C1C(c1ccc(cc1)(N+)(=O)(O))N(c1c(N2)cccc1)C(=O)c1ccccc1)c1ccccc1
STK038294
ZINC000009246703
ZINC000009246708

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Available files

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