Vitas-M small molecule compound
11-(3-butoxyphenyl)-3,3-dimethyl-10-(trifluoroacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK139412
SMILES CCCCOc1cccc(c1)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 C27H29F3N2O3 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29F3N2O3/c1-4-5-13-35-18-10-8-9-17(14-18)24-23-20(15-26(2,3)16-22(23)33)31-19-11-6-7-12-21(19)32(24)25(34)27(28,29)30/h6-12,14,24,31H,4-5,13,15-16H2,1-3H3InChIKey
SZPZENFVPMQHFL-UHFFFAOYSA-NSynonyms
353772-54-011(3butoxyphenyl)33dimethyl10(222trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(3butoxyphenyl)33dimethyl10(trifluoroacetyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
353772540
6(3butoxyphenyl)99dimethyl5(222trifluoroacetyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=CC(=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2C(=O)C(F)(F)F
InChI=1SC27H29F3N2O3c145133518108917(1418)242320(1526(23)1622(23)33)311911671221(19)32(24)25(34)27(2829)30h612142431H45131516H213H3
MFCD01921839
ZINC000008443880
ZINC000008443883
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