Vitas-M small molecule compound
1-[3,3-bis(4-bromophenyl)-3'-(3-chlorophenyl)-3H,3'H-spiro[2-benzothiophene-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone
Catalog ID
STK675808
SMILES Brc1ccc(cc1)C1(SC2(c3c1cccc3)SC(=NN2c1cccc(c1)Cl)C(=O)C)c1ccc(cc1)Br
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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 C29H19Br2ClN2OS2 MW 670.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19Br2ClN2OS2/c1-18(35)27-33-34(24-6-4-5-23(32)17-24)29(36-27)26-8-3-2-7-25(26)28(37-29,19-9-13-21(30)14-10-19)20-11-15-22(31)16-12-20/h2-17H,1H3InChIKey
LLDAWHYRYJBRBT-UHFFFAOYSA-NSynonyms
1(33bis(4bromophenyl)3(3chlorophenyl)3H3Hspiro(2benzothiophene12(134)thiadiazol)5yl)ethanone
1(33BIS(4BROMOPHENYL)4(3CHLOROPHENYL)SPIRO(134THIADIAZOLE512BENZOTHIOPHENE)2YL)ETHANONE
CC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(S2)(C4=CC=C(C=C4)Br)C5=CC=C(C=C5)Br)C6=CC(=CC=C6)Cl
InChI=1SC29H19Br2ClN2OS2c118(35)273334(2464523(32)1724)29(3627)26832725(26)28(37291991321(30)141019)20111522(31)161220h217H1H3
MFCD01575646
ZINC000008443942
ZINC000008443946
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