Vitas-M small molecule compound
3-(4-methylphenyl)-11-[2-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK068000
SMILES Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1C(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 C27H23F3N2O MW 448.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23F3N2O/c1-16-10-12-17(13-11-16)18-14-23-25(24(33)15-18)26(32-22-9-5-4-8-21(22)31-23)19-6-2-3-7-20(19)27(28,29)30/h2-13,18,26,31-32H,14-15H2,1H3InChIKey
SWLSQKIALIIEJM-UHFFFAOYSA-NSynonyms
3(4methylphenyl)11(2(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4methylphenyl)6(2(trifluoromethyl)phenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=CC=C5C(F)(F)F)C(=O)C2
Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccccc1C(F)(F)F
InChI=1SC27H23F3N2Oc116101217(131116)18142325(24(33)1518)26(3222954821(22)3123)19623720(19)27(2829)30h21318263132H1415H21H3
MFCD03409169
STK068000
ZINC000008846694
ZINC000008846697
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