Vitas-M small molecule compound
11-(2-chloro-6-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK078879
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1c(F)cccc1Cl
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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 C21H20ClFN2O MW 370.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClFN2O/c1-21(2)10-16-19(17(26)11-21)20(18-12(22)6-5-7-13(18)23)25-15-9-4-3-8-14(15)24-16/h3-9,20,24-25H,10-11H2,1-2H3InChIKey
JLWXMZCERBMWOR-UHFFFAOYSA-NSynonyms
337502-66-611(2chloro6fluorophenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
337502666
6(2chloro6fluorophenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=C(C=CC=C4Cl)F)C(=O)C1)C
InChI=1SC21H20ClFN2Oc121(2)101619(17(26)1121)20(1812(22)65713(18)23)2515943814(15)2416h39202425H1011H212H3
MFCD01920344
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1c(F)cccc1Cl
STK078879
ZINC000018136401
ZINC000018136403
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