Vitas-M small molecule compound
3-(furan-2-yl)-11-(3-nitrophenyl)-10-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL172235
SMILES O=C1CC(CC2=C1C(c1cccc(c1)[N+](=O)[O-])N(C(=O)c1ccccc1)c1c(N2)cccc1)c1ccco1
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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 C30H23N3O5 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N3O5/c34-26-18-21(27-14-7-15-38-27)17-24-28(26)29(20-10-6-11-22(16-20)33(36)37)32(25-13-5-4-12-23(25)31-24)30(35)19-8-2-1-3-9-19/h1-16,21,29,31H,17-18H2InChIKey
KINWNGNCMCOSKE-UHFFFAOYSA-NSynonyms
438476-26-73(furan2yl)11(3nitrophenyl)10(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
438476267
5benzoyl9(furan2yl)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=CO6
InChI=1SC30H23N3O5c34261821(27147153827)172428(26)29(201061122(1620)33(36)37)32(2513541223(25)3124)30(35)198213919h116212931H1718H2
MFCD01922774
O=C1CC(CC2=C1C(c1cccc(c1)(N+)(=O)(O))N(C(=O)c1ccccc1)c1c(N2)cccc1)c1ccco1
ZINC000000674112
ZINC000000674118
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