Vitas-M small molecule compound

ethyl 2-{[(4-chlorophenoxy)acetyl]amino}-4-methyl-5-(piperidin-1-ylcarbonyl)thiophene-3-carboxylate

Catalog ID
STK052840
SMILES CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)C(=O)N1CCCCC1

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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 C22H25ClN2O5S MW 464.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O5S/c1-3-29-22(28)18-14(2)19(21(27)25-11-5-4-6-12-25)31-20(18)24-17(26)13-30-16-9-7-15(23)8-10-16/h7-10H,3-6,11-13H2,1-2H3,(H,24,26)
InChIKey
HRCHJSBVHSAHMC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)N2CCCCC2)NC(=O)COC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)C(=O)N1CCCCC1
ETHYL2(((4CHLOROPHENOXY)ACETYL)AMINO)4METHYL5(1PIPERIDINYLCARBONYL)3THIOPHENECARBOXYLATE
ETHYL2(((4CHLOROPHENOXY)ACETYL)AMINO)4METHYL5(PIPERIDIN1YLCARBONYL)THIOPHENE3CARBOXYLATE
ETHYL2((2(4CHLOROPHENOXY)ACETYL)AMINO)4METHYL5(PIPERIDINE1CARBONYL)THIOPHENE3CARBOXYLATE
ETHYL2(2(4CHLOROPHENOXY)ACETYLAMINO)4METHYL5(PIPERIDYLCARBONYL)THIOPHENE3CARBOXYLATE
InChI=1SC22H25ClN2O5Sc132922(28)1814(2)19(21(27)25115461225)3120(18)2417(26)1330169715(23)81016h710H361113H212H3(H2426)
MFCD02104950
STK052840
ZINC000000710679
ZINC00710679
ZINC710679

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Available files

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