Vitas-M small molecule compound
1-[11-(furan-2-yl)-1-hydroxy-3-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one
Catalog ID
STK564468
SMILES CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)[N+](=O)[O-])C1c1ccco1
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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/c1-2-3-4-14-27(34)31-24-12-6-5-11-22(24)30-23-17-20(19-9-7-10-21(16-19)32(35)36)18-25(33)28(23)29(31)26-13-8-15-37-26/h5-13,15-16,20,29,33H,2-4,14,17-18H2,1H3InChIKey
HIPOUBMEQUKABJ-UHFFFAOYSA-NSynonyms
1(11(furan2yl)1hydroxy3(3nitrophenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2cccc(c2)(N+)(=O)(O))C1c1ccco1
MFCD03796992
ZINC000102648386
ZINC000102648393
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