Vitas-M small molecule compound
3,3-dimethyl-11-[3-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK060124
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1)C(F)(F)F
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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 C22H21F3N2O MW 386.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N2O/c1-21(2)11-17-19(18(28)12-21)20(27-16-9-4-3-8-15(16)26-17)13-6-5-7-14(10-13)22(23,24)25/h3-10,20,26-27H,11-12H2,1-2H3InChIKey
MPILGQLMLLPXKN-UHFFFAOYSA-NSynonyms
299921-83-8299921838
33dimethyl11(3(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
99dimethyl6(3(trifluoromethyl)phenyl)681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=CC=C4)C(F)(F)F)C(=O)C1)C
InChI=1SC22H21F3N2Oc121(2)111719(18(28)1221)20(2716943815(16)2617)1365714(1013)22(2324)25h310202627H1112H212H3
MFCD01823913
O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cccc1)c1cccc(c1)C(F)(F)F
STK060124
ZINC000018115891
ZINC000018115893
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