Vitas-M small molecule compound
1-[3-(4-chlorophenyl)-11-(4-fluorophenyl)-1-hydroxy-3,4,11,11a-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]ethanone
Catalog ID
STL169483
SMILES Fc1ccc(cc1)C1C2C(=CC(CC2=Nc2c(N1C(=O)C)cccc2)c1ccc(cc1)Cl)O
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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 C27H22ClFN2O2 MW 460.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClFN2O2/c1-16(32)31-24-5-3-2-4-22(24)30-23-14-19(17-6-10-20(28)11-7-17)15-25(33)26(23)27(31)18-8-12-21(29)13-9-18/h2-13,15,19,26-27,33H,14H2,1H3InChIKey
UUPLKWYRPMOBOB-UHFFFAOYSA-NSynonyms
1(3(4chlorophenyl)11(4fluorophenyl)1hydroxy341111atetrahydro10Hdibenzo(be)(14)diazepin10yl)ethanone
1(9(4CHLOROPHENYL)6(4FLUOROPHENYL)7HYDROXY66A910TETRAHYDROBENZO(B)(14)BENZODIAZEPIN5YL)ETHANONE
CC(=O)N1C(C2C(=NC3=CC=CC=C31)CC(C=C2O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)F
InChI=1SC27H22ClFN2O2c116(32)3124532422(24)30231419(1761020(28)11717)1525(33)26(23)27(31)1881221(29)13918h2131519262733H14H21H3
MFCD03033388
ZINC000102435904
ZINC000245253952
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