Vitas-M small molecule compound
2-{[4-(4-bromophenyl)-5-(2,3-dimethyl-1H-indol-5-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(1H-indol-3-yl)ethanone
Catalog ID
STK384649
SMILES Brc1ccc(cc1)n1c(SCC(=O)c2c[nH]c3c2cccc3)nnc1c1ccc2c(c1)c(C)c([nH]2)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 C28H22BrN5OS MW 556.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrN5OS/c1-16-17(2)31-25-12-7-18(13-22(16)25)27-32-33-28(34(27)20-10-8-19(29)9-11-20)36-15-26(35)23-14-30-24-6-4-3-5-21(23)24/h3-14,30-31H,15H2,1-2H3InChIKey
CBPAFEDQNMZLEF-UHFFFAOYSA-NSynonyms
2((4(4BROMOPHENYL)5(23DIMETHYL1HINDOL5YL)124TRIAZOL3YL)SULFANYL)1(1HINDOL3YL)ETHANONE
2((4(4bromophenyl)5(23dimethyl1Hindol5yl)4H124triazol3yl)sulfanyl)1(1Hindol3yl)ethanone
2(5(23DIMETHYLINDOL5YL)4(4BROMOPHENYL)(124TRIAZOL3YLTHIO))1INDOL3YLETHAN1ONE
Brc1ccc(cc1)n1c(SCC(=O)c2c(nH)c3c2cccc3)nnc1c1ccc2c(c1)c(C)c((nH)2)C
CC1=C(NC2=C1C=C(C=C2)C3=NN=C(N3C4=CC=C(C=C4)Br)SCC(=O)C5=CNC6=CC=CC=C65)C
InChI=1SC28H22BrN5OSc11617(2)312512718(1322(16)25)27323328(34(27)2010819(29)91120)361526(35)23143024643521(23)24h3143031H15H212H3
MFCD04966755
ZINC000002911421
ZINC2911421
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