Vitas-M small molecule compound
3-(4-tert-butylphenyl)-10-(2-methylpropanoyl)-11-(3-nitrophenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK024103
SMILES CC(C(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)c1ccc(cc1)C(C)(C)C)C
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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 C33H35N3O4 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O4/c1-20(2)32(38)35-28-12-7-6-11-26(28)34-27-18-23(21-13-15-24(16-14-21)33(3,4)5)19-29(37)30(27)31(35)22-9-8-10-25(17-22)36(39)40/h6-17,20,23,31,34H,18-19H2,1-5H3InChIKey
LLYWPZMAOVCHNV-UHFFFAOYSA-NSynonyms
523992-45-23(4(tertbutyl)phenyl)10isobutyryl11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4tertbutylphenyl)10(2methylpropanoyl)11(3nitrophenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
523992452
9(4tertbutylphenyl)5(2methylpropanoyl)6(3nitrophenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C(=O)N1c2ccccc2NC2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)c1ccc(cc1)C(C)(C)C)C
CC(C)C(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC33H35N3O4c120(2)32(38)352812761126(28)34271823(21131524(161421)33(34)5)1929(37)30(27)31(35)22981025(1722)36(39)40h61720233134H1819H215H3
MFCD03488954
STK024103
ZINC000053307242
ZINC000097945863
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.