Vitas-M small molecule compound

ethyl 5-methyl-2-({[2-(4-propylphenyl)quinolin-4-yl]carbonyl}amino)thiophene-3-carboxylate

Catalog ID
STK422516
SMILES CCCc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc(cc1C(=O)OCC)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 C27H26N2O3S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O3S/c1-4-8-18-11-13-19(14-12-18)24-16-21(20-9-6-7-10-23(20)28-24)25(30)29-26-22(15-17(3)33-26)27(31)32-5-2/h6-7,9-16H,4-5,8H2,1-3H3,(H,29,30)
InChIKey
LKXJKUGHGGZLRE-UHFFFAOYSA-N
Synonyms

CCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=C(S4)C)C(=O)OCC
ETHYL5METHYL2(((2(4PROPYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
ethyl5methyl2(((2(4propylphenyl)quinolin4yl)carbonyl)amino)thiophene3carboxylate
ETHYL5METHYL2((2(4PROPYLPHENYL)(4QUINOLYL))CARBONYLAMINO)THIOPHENE3CARBOXYLATE
ETHYL5METHYL2((2(4PROPYLPHENYL)QUINOLINE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC27H26N2O3Sc14818111319(141218)241621(209671023(20)2824)25(30)292622(1517(3)3326)27(31)3252h67916H458H213H3(H2930)
MFCD02245156
ZINC000002105840
ZINC02105840
ZINC2105840

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Available files

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