Vitas-M small molecule compound

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

Catalog ID
STK093798
SMILES O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)[N+](=O)[O-])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 C25H21N3O3 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3/c29-23-15-18(16-6-2-1-3-7-16)14-22-24(23)25(17-10-12-19(13-11-17)28(30)31)27-21-9-5-4-8-20(21)26-22/h1-13,18,25-27H,14-15H2
InChIKey
MRSJSBXNVZZELH-UHFFFAOYSA-N
Synonyms

11(4nitrophenyl)3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4NITROPHENYL)3PHENYL234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(4nitrophenyl)9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3NC2C4=CC=C(C=C4)(N+)(=O)(O))C5=CC=CC=C5
InChI=1SC25H21N3O3c29231518(166213716)142224(23)25(17101219(131117)28(30)31)2721954820(21)2622h113182527H1415H2
MFCD01874268
O=C1CC(CC2=C1C(Nc1c(N2)cccc1)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
STK093798
ZINC000001082735
ZINC000001082738

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Available files

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