Vitas-M small molecule compound
3,3-dimethyl-11-[4-(pentyloxy)phenyl]-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL023660
SMILES CCCCCOc1ccc(cc1)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 C28H31F3N2O3 MW 500.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31F3N2O3/c1-4-5-8-15-36-19-13-11-18(12-14-19)25-24-21(16-27(2,3)17-23(24)34)32-20-9-6-7-10-22(20)33(25)26(35)28(29,30)31/h6-7,9-14,25,32H,4-5,8,15-17H2,1-3H3InChIKey
FSHLKZFRDMHFKR-UHFFFAOYSA-NSynonyms
406914-56-533dimethyl11(4(pentyloxy)phenyl)10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
33dimethyl11(4(pentyloxy)phenyl)10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
406914565
99dimethyl6(4pentoxyphenyl)5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)C(F)(F)F
InChI=1SC28H31F3N2O3c1458153619131118(121419)252421(1627(23)1723(24)34)32209671022(20)33(25)26(35)28(2930)31h679142532H4581517H213H3
MFCD01921671
ZINC000009380017
ZINC000009380740
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