Vitas-M small molecule compound

3,3-dimethyl-10-(phenylacetyl)-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK206836
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)C(F)(F)F)N(C(=O)Cc1ccccc1)c1c(N2)cccc1

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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 C30H27F3N2O2 MW 504.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27F3N2O2/c1-29(2)17-23-27(25(36)18-29)28(20-12-14-21(15-13-20)30(31,32)33)35(24-11-7-6-10-22(24)34-23)26(37)16-19-8-4-3-5-9-19/h3-15,28,34H,16-18H2,1-2H3
InChIKey
RCQIMLFWBFTYMJ-UHFFFAOYSA-N
Synonyms
372495-17-5
33dimethyl10(2phenylacetyl)11(4(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl10(phenylacetyl)11(4(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
372495175
99dimethyl5(2phenylacetyl)6(4(trifluoromethyl)phenyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)CC4=CC=CC=C4)C5=CC=C(C=C5)C(F)(F)F)C(=O)C1)C
InChI=1SC30H27F3N2O2c129(2)172327(25(36)1829)28(20121421(151320)30(3132)33)35(2411761022(24)3423)26(37)16198435919h3152834H1618H212H3
MFCD01919340
ZINC000009183476
ZINC000017123840

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Available files

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