Vitas-M small molecule compound
1-{1-hydroxy-3,3-dimethyl-11-[5-(3-nitrophenyl)furan-2-yl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}-2-methylpropan-1-one
Catalog ID
STL150389
SMILES CC(C(=O)N1C(c2ccc(o2)c2cccc(c2)[N+](=O)[O-])C2=C(O)CC(CC2=Nc2c1cccc2)(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 C29H29N3O5 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5/c1-17(2)28(34)31-22-11-6-5-10-20(22)30-21-15-29(3,4)16-23(33)26(21)27(31)25-13-12-24(37-25)18-8-7-9-19(14-18)32(35)36/h5-14,17,27,33H,15-16H2,1-4H3InChIKey
RVAZCUKDGZDMPQ-UHFFFAOYSA-NSynonyms
1(1hydroxy33dimethyl11(5(3nitrophenyl)furan2yl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)2methylpropan1one
CC(C(=O)N1C(c2ccc(o2)c2cccc(c2)(N+)(=O)(O))C2=C(O)CC(CC2=Nc2c1cccc2)(C)C)C
MFCD03793892
ZINC000101639469
ZINC000101639473
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