Vitas-M small molecule compound
6-bromo-2-(4-butylphenyl)-N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide
Catalog ID
STK429030
SMILES CCCCc1ccc(cc1)c1nc2ccc(cc2c(c1)C(=O)Nc1sc2c(c1C(=O)N)CCC(C2)C)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 C30H30BrN3O2S MW 576.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H30BrN3O2S/c1-3-4-5-18-7-9-19(10-8-18)25-16-23(22-15-20(31)11-13-24(22)33-25)29(36)34-30-27(28(32)35)21-12-6-17(2)14-26(21)37-30/h7-11,13,15-17H,3-6,12,14H2,1-2H3,(H2,32,35)(H,34,36)InChIKey
BFPUTYNSCCMSJG-UHFFFAOYSA-NSynonyms
6bromo2(4butylphenyl)N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)quinoline4carboxamide
CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C5=C(S4)CC(CC5)C)C(=O)N
InChI=1SC30H30BrN3O2Sc1345187919(10818)251623(221520(31)111324(22)3325)29(36)343027(28(32)35)2112617(2)1426(21)3730h711131517H361214H212H3(H23235)(H3436)
MFCD03233232
ZINC000002789183
ZINC000002789184
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