Vitas-M small molecule compound
methyl 2-({[2-(4-bromophenyl)quinolin-4-yl]carbonyl}amino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK428022
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cc(nc2c1cccc2)c1ccc(cc1)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 C28H25BrN2O3S MW 549.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25BrN2O3S/c1-3-16-8-13-20-24(14-16)35-27(25(20)28(33)34-2)31-26(32)21-15-23(17-9-11-18(29)12-10-17)30-22-7-5-4-6-19(21)22/h4-7,9-12,15-16H,3,8,13-14H2,1-2H3,(H,31,32)InChIKey
QJRYOAYSLAFASR-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br
InChI=1SC28H25BrN2O3Sc13168132024(1416)3527(25(20)28(33)342)3126(32)211523(1791118(29)121017)3022754619(21)22h479121516H381314H212H3(H3132)
methyl2(((2(4bromophenyl)quinolin4yl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(4bromophenyl)quinoline4carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD01340840
ZINC000002736870
ZINC000002736871
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