Vitas-M small molecule compound
11-(2,4-dimethoxyphenyl)-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL170942
SMILES COc1ccc(c(c1)OC)C1C2=C(Nc3c(N1C(=O)C(F)(F)F)cccc3)CC(CC2=O)(C)C
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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 C25H25F3N2O4 MW 474.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25F3N2O4/c1-24(2)12-17-21(19(31)13-24)22(15-10-9-14(33-3)11-20(15)34-4)30(23(32)25(26,27)28)18-8-6-5-7-16(18)29-17/h5-11,22,29H,12-13H2,1-4H3InChIKey
ZXYCFNBHOFUGTN-UHFFFAOYSA-NSynonyms
11(24dimethoxyphenyl)33dimethyl10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(24dimethoxyphenyl)99dimethyl5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C(F)(F)F)C4=C(C=C(C=C4)OC)OC)C(=O)C1)C
InChI=1SC25H25F3N2O4c124(2)121721(19(31)1324)22(1510914(333)1120(15)344)30(23(32)25(2627)28)18865716(18)2917h5112229H1213H214H3
MFCD01417428
ZINC000000682650
ZINC000000682651
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