Vitas-M small molecule compound
10-acetyl-3-(thiophen-2-yl)-11-[4-(trifluoromethyl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK766525
SMILES O=C1CC(CC2=C1C(c1ccc(cc1)C(F)(F)F)N(C(=O)C)c1c(N2)cccc1)c1cccs1
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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 C26H21F3N2O2S MW 482.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21F3N2O2S/c1-15(32)31-21-6-3-2-5-19(21)30-20-13-17(23-7-4-12-34-23)14-22(33)24(20)25(31)16-8-10-18(11-9-16)26(27,28)29/h2-12,17,25,30H,13-14H2,1H3InChIKey
NFZPJTXWBBCGAD-UHFFFAOYSA-NSynonyms
10acetyl3(thiophen2yl)11(4(trifluoromethyl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5acetyl9thiophen2yl6(4(trifluoromethyl)phenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CS3)NC4=CC=CC=C41)C5=CC=C(C=C5)C(F)(F)F
InChI=1SC26H21F3N2O2Sc115(32)3121632519(21)30201317(2374123423)1422(33)24(20)25(31)1681018(11916)26(2728)29h212172530H1314H21H3
MFCD03036133
ZINC000000718094
ZINC000000718097
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