Vitas-M small molecule compound
1-(11-{4-[(4-chlorobenzyl)oxy]-3-ethoxyphenyl}-1-hydroxy-3-phenyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl)-2,2,2-trifluoroethanone
Catalog ID
STK089293
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)c1ccccc1
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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 C36H30ClF3N2O4 MW 647.09 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30ClF3N2O4/c1-2-45-32-20-24(14-17-31(32)46-21-22-12-15-26(37)16-13-22)34-33-28(18-25(19-30(33)43)23-8-4-3-5-9-23)41-27-10-6-7-11-29(27)42(34)35(44)36(38,39)40/h3-17,20,25,34,43H,2,18-19,21H2,1H3InChIKey
FPLVFHJDZSWAGN-UHFFFAOYSA-NSynonyms
1(11(4((4chlorobenzyl)oxy)3ethoxyphenyl)1hydroxy3phenyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)222trifluoroethanone
CCOc1cc(ccc1OCc1ccc(cc1)Cl)C1C2=C(O)CC(CC2=Nc2c(N1C(=O)C(F)(F)F)cccc2)c1ccccc1
MFCD03033932
STK089293
ZINC000150419638
ZINC000150419662
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