Vitas-M small molecule compound
3,3-dimethyl-11-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK135059
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1ccc(cc1C)[N+](=O)[O-])N(C(=O)c1ccccc1)c1c(N2)cccc1
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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 C33H29N3O5 MW 547.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O5/c1-20-17-22(36(39)40)13-14-23(20)28-15-16-29(41-28)31-30-25(18-33(2,3)19-27(30)37)34-24-11-7-8-12-26(24)35(31)32(38)21-9-5-4-6-10-21/h4-17,31,34H,18-19H2,1-3H3InChIKey
IPWSEMBACCESFP-UHFFFAOYSA-NSynonyms
371118-52-410benzoyl33dimethyl11(5(2methyl4nitrophenyl)furan2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl11(5(2methyl4nitrophenyl)furan2yl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
371118524
5benzoyl99dimethyl6(5(2methyl4nitrophenyl)furan2yl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1=C(C=CC(=C1)(N+)(=O)(O))C2=CC=C(O2)C3C4=C(CC(CC4=O)(C)C)NC5=CC=CC=C5N3C(=O)C6=CC=CC=C6
InChI=1SC33H29N3O5c1201722(36(39)40)131423(20)28151629(4128)313025(1833(23)1927(30)37)342411781226(24)35(31)32(38)2195461021h4173134H1819H213H3
MFCD01921295
O=C1CC(C)(C)CC2=C1C(c1ccc(o1)c1ccc(cc1C)(N+)(=O)(O))N(C(=O)c1ccccc1)c1c(N2)cccc1
ZINC000053307162
ZINC000097951289
Check stock
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Check stock on Vitas-MAvailable files
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