Vitas-M small molecule compound

methyl 2-{[(6-bromo-2-phenylquinolin-4-yl)carbonyl]amino}-5-methylthiophene-3-carboxylate

Catalog ID
STK422437
SMILES COC(=O)c1cc(sc1NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccccc1)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 C23H17BrN2O3S MW 481.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17BrN2O3S/c1-13-10-18(23(28)29-2)22(30-13)26-21(27)17-12-20(14-6-4-3-5-7-14)25-19-9-8-15(24)11-16(17)19/h3-12H,1-2H3,(H,26,27)
InChIKey
AJXLQENOTCOASP-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4)C(=O)OC
InChI=1SC23H17BrN2O3Sc1131018(23(28)292)22(3013)2621(27)171220(146435714)25199815(24)1116(17)19h312H12H3(H2627)
methyl2(((6bromo2phenylquinolin4yl)carbonyl)amino)5methylthiophene3carboxylate
METHYL2((6BROMO2PHENYL(4QUINOLYL))CARBONYLAMINO)5METHYLTHIOPHENE3CARBOXYLATE
METHYL2((6BROMO2PHENYLQUINOLINE4CARBONYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
MFCD02176433
ZINC000002759201
ZINC02759201
ZINC2759201

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Available files

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