Vitas-M small molecule compound
methyl 2-({[2-(3-bromophenyl)quinolin-4-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418228
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2cccc(c2)Br)sc2c1CCC(C2)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 C27H23BrN2O3S MW 535.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrN2O3S/c1-15-10-11-19-23(12-15)34-26(24(19)27(32)33-2)30-25(31)20-14-22(16-6-5-7-17(28)13-16)29-21-9-4-3-8-18(20)21/h3-9,13-15H,10-12H2,1-2H3,(H,30,31)InChIKey
XUOUEJOXPWNCMP-UHFFFAOYSA-NSynonyms
438616-76-3438616763
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)Br
InChI=1SC27H23BrN2O3Sc11510111923(1215)3426(24(19)27(32)332)3025(31)201422(1665717(28)1316)2921943818(20)21h391315H1012H212H3(H3031)
methyl2(((2(3bromophenyl)quinolin4yl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3bromophenyl)quinoline4carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD01919617
ZINC000002084714
ZINC000002084715
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