Vitas-M small molecule compound

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

Catalog ID
STK316010
SMILES Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)[N+](=O)[O-])C(=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 C32H24ClN3O4 MW 550.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24ClN3O4/c33-24-15-13-20(14-16-24)23-18-27-30(29(37)19-23)31(22-9-6-10-25(17-22)36(39)40)35(28-12-5-4-11-26(28)34-27)32(38)21-7-2-1-3-8-21/h1-17,23,31,34H,18-19H2
InChIKey
TYEXOVCCGDDLER-UHFFFAOYSA-N
Synonyms
445243-73-2
3(4chlorophenyl)11(3nitrophenyl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
445243732
5benzoyl9(4chlorophenyl)6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
C1C(CC(=O)C2=C1NC3=CC=CC=C3N(C2C4=CC(=CC=C4)(N+)(=O)(O))C(=O)C5=CC=CC=C5)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1cccc(c1)(N+)(=O)(O))C(=O)c1ccccc1
InChI=1SC32H24ClN3O4c3324151320(141624)23182730(29(37)1923)31(22961025(1722)36(39)40)35(2812541126(28)3427)32(38)217213821h117233134H1819H2
MFCD02175325
ZINC000002109843
ZINC000008450854
ZINC08450854

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Available files

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