Vitas-M small molecule compound
11-(4-methylphenyl)-3-(3-nitrophenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK741920
SMILES Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccc(c2)[N+](=O)[O-])Nc2c(N1C(=O)c1ccccc1)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 C33H27N3O4 MW 529.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27N3O4/c1-21-14-16-22(17-15-21)32-31-28(19-25(20-30(31)37)24-10-7-11-26(18-24)36(39)40)34-27-12-5-6-13-29(27)35(32)33(38)23-8-3-2-4-9-23/h2-18,25,32,34H,19-20H2,1H3InChIKey
QDKWPZAMUKLLLI-UHFFFAOYSA-NSynonyms
10benzoyl3(3nitrophenyl)11(ptolyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4methylphenyl)3(3nitrophenyl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5benzoyl6(4methylphenyl)9(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=CC=C4)(N+)(=O)(O))NC5=CC=CC=C5N2C(=O)C6=CC=CC=C6
Cc1ccc(cc1)C1C2=C(CC(CC2=O)c2cccc(c2)(N+)(=O)(O))Nc2c(N1C(=O)c1ccccc1)cccc2
InChI=1SC33H27N3O4c121141622(171521)323128(1925(2030(31)37)241071126(1824)36(39)40)342712561329(27)35(32)33(38)238324923h218253234H1920H21H3
MFCD01957792
ZINC000053332054
ZINC000053332068
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