Vitas-M small molecule compound
6-bromo-N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-phenylquinoline-4-carboxamide
Catalog ID
STK422423
SMILES N#Cc1c(NC(=O)c2cc(nc3c2cc(Br)cc3)c2ccccc2)sc2c1CCC(C2)C(C)(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 C29H26BrN3OS MW 544.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26BrN3OS/c1-29(2,3)18-9-11-20-23(16-31)28(35-26(20)13-18)33-27(34)22-15-25(17-7-5-4-6-8-17)32-24-12-10-19(30)14-21(22)24/h4-8,10,12,14-15,18H,9,11,13H2,1-3H3,(H,33,34)InChIKey
AXXRGWCYWKRQEX-UHFFFAOYSA-NSynonyms
6bromoN(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)2phenylquinoline4carboxamide
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5
InChI=1SC29H26BrN3OSc129(23)189112023(1631)28(3526(20)1318)3327(34)221525(177546817)3224121019(30)1421(22)24h481012141518H91113H213H3(H3334)
MFCD02176378
ZINC000002759133
ZINC000002759134
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