Vitas-M small molecule compound
11-(2-ethoxyphenyl)-10-hexanoyl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK079321
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1OCC)C(=O)CC(C2)(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 C29H36N2O3 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N2O3/c1-5-7-8-17-26(33)31-23-15-11-10-14-21(23)30-22-18-29(3,4)19-24(32)27(22)28(31)20-13-9-12-16-25(20)34-6-2/h9-16,28,30H,5-8,17-19H2,1-4H3InChIKey
DMRIFLNQRCKWNA-UHFFFAOYSA-NSynonyms
438466-37-611(2ethoxyphenyl)10hexanoyl33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
438466376
6(2ethoxyphenyl)5hexanoyl99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=CC=C4OCC
CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1OCC)C(=O)CC(C2)(C)C
InChI=1SC29H36N2O3c15781726(33)31231511101421(23)30221829(34)1924(32)27(22)28(31)20139121625(20)3462h9162830H581719H214H3
MFCD01922032
STK079321
ZINC000008444046
ZINC000008444047
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