Vitas-M small molecule compound

methyl 6-methyl-2-({[2-(pyridin-3-yl)quinolin-4-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK414802
SMILES COC(=O)c1c(NC(=O)c2cc(nc3c2cccc3)c2cccnc2)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 C26H23N3O3S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O3S/c1-15-9-10-18-22(12-15)33-25(23(18)26(31)32-2)29-24(30)19-13-21(16-6-5-11-27-14-16)28-20-8-4-3-7-17(19)20/h3-8,11,13-15H,9-10,12H2,1-2H3,(H,29,30)
InChIKey
SVDHZWWACCKJRA-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5
InChI=1SC26H23N3O3Sc1159101822(1215)3325(23(18)26(31)322)2924(30)191321(166511271416)2820843717(19)20h38111315H91012H212H3(H2930)
methyl6methyl2(((2(pyridin3yl)quinolin4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2((2pyridin3ylquinoline4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD05999653
ZINC000001073328
ZINC000001073329

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.