Vitas-M small molecule compound

methyl 2-({[6-bromo-2-(3-methylphenyl)quinolin-4-yl]carbonyl}amino)-5-(propan-2-yl)thiophene-3-carboxylate

Catalog ID
STK429766
SMILES COC(=O)c1cc(sc1NC(=O)c1cc(nc2c1cc(Br)cc2)c1cccc(c1)C)C(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 C26H23BrN2O3S MW 523.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O3S/c1-14(2)23-13-20(26(31)32-4)25(33-23)29-24(30)19-12-22(16-7-5-6-15(3)10-16)28-21-9-8-17(27)11-18(19)21/h5-14H,1-4H3,(H,29,30)
InChIKey
CGRLOIUOLKHCHA-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)C(C)C)C(=O)OC
InChI=1SC26H23BrN2O3Sc114(2)231320(26(31)324)25(3323)2924(30)191222(1675615(3)1016)28219817(27)1118(19)21h514H14H3(H2930)
METHYL2(((6BROMO2(3METHYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)5ISOPROPYL3THIOPHENECARBOXYLATE
methyl2(((6bromo2(3methylphenyl)quinolin4yl)carbonyl)amino)5(propan2yl)thiophene3carboxylate
METHYL2((6BROMO2(3METHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXYLATE
METHYL2((6BROMO2(3METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)5PROPAN2YLTHIOPHENE3CARBOXYLATE
MFCD03233366
ZINC000002801221
ZINC02801221
ZINC2801221

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Available files

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