Vitas-M small molecule compound

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

Catalog ID
STK422523
SMILES CCCc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)Nc1sc(c(c1C(=O)OC)C)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/c1-5-8-18-11-13-19(14-12-18)23-15-21(20-9-6-7-10-22(20)28-23)25(30)29-26-24(27(31)32-4)16(2)17(3)33-26/h6-7,9-15H,5,8H2,1-4H3,(H,29,30)
InChIKey
QLHTYDCQOFHXED-UHFFFAOYSA-N
Synonyms

CCCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C)C(=O)OC
InChI=1SC27H26N2O3Sc15818111319(141218)231521(209671022(20)2823)25(30)292624(27(31)324)16(2)17(3)3326h67915H58H214H3(H2930)
METHYL45DIMETHYL2(((2(4PROPYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
methyl45dimethyl2(((2(4propylphenyl)quinolin4yl)carbonyl)amino)thiophene3carboxylate
METHYL45DIMETHYL2((2(4PROPYLPHENYL)(4QUINOLYL))CARBONYLAMINO)THIOPHENE3CARBOXYLATE
METHYL45DIMETHYL2((2(4PROPYLPHENYL)QUINOLINE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD02244989
ZINC000002105992
ZINC02105992
ZINC2105992

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Available files

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