Vitas-M small molecule compound
6-bromo-N-(3-carbamoyl-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-methylphenyl)quinoline-4-carboxamide
Catalog ID
STK430545
SMILES CCC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1cc(nc2c1cc(Br)cc2)c1cccc(c1)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 C28H26BrN3O2S MW 548.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26BrN3O2S/c1-3-16-7-9-19-24(12-16)35-28(25(19)26(30)33)32-27(34)21-14-23(17-6-4-5-15(2)11-17)31-22-10-8-18(29)13-20(21)22/h4-6,8,10-11,13-14,16H,3,7,9,12H2,1-2H3,(H2,30,33)(H,32,34)InChIKey
NKLSGBMRWAFEFL-UHFFFAOYSA-NSynonyms
6bromoN(3carbamoyl6ethyl4567tetrahydro1benzothiophen2yl)2(3methylphenyl)quinoline4carboxamide
CCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC(=CC=C5)C
InChI=1SC28H26BrN3O2Sc1316791924(1216)3528(25(19)26(30)33)3227(34)211423(1764515(2)1117)312210818(29)1320(21)22h4681011131416H37912H212H3(H23033)(H3234)
MFCD03074315
ZINC000002111393
ZINC000002111396
ZINC02111393
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