Vitas-M small molecule compound

ethyl 4-methyl-2-({2-oxo-2-phenyl-1-[(thiophen-2-ylcarbonyl)amino]ethyl}amino)-5-(phenylcarbamoyl)thiophene-3-carboxylate

Catalog ID
STK861435
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccccc1)NC(C(=O)c1ccccc1)NC(=O)c1cccs1

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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 C28H25N3O5S2 MW 547.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5S2/c1-3-36-28(35)21-17(2)23(26(34)29-19-13-8-5-9-14-19)38-27(21)31-24(22(32)18-11-6-4-7-12-18)30-25(33)20-15-10-16-37-20/h4-16,24,31H,3H2,1-2H3,(H,29,34)(H,30,33)
InChIKey
XHRWYFLBKOXVDL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(C(=O)C3=CC=CC=C3)NC(=O)C4=CC=CS4
ethyl4methyl2((2oxo2phenyl1((thiophen2ylcarbonyl)amino)ethyl)amino)5(phenylcarbamoyl)thiophene3carboxylate
ethyl4methyl2((2oxo2phenyl1(thiophene2carbonylamino)ethyl)amino)5(phenylcarbamoyl)thiophene3carboxylate
InChI=1SC28H25N3O5S2c133628(35)2117(2)23(26(34)2919138591419)3827(21)3124(22(32)18116471218)3025(33)201510163720h4162431H3H212H3(H2934)(H3033)
MFCD01014540
ZINC000033358612
ZINC000033358613

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Available files

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