Vitas-M small molecule compound

methyl 3-({[4-(5-chloro-2-methoxybenzyl)piperazin-1-yl]carbonyl}amino)thiophene-2-carboxylate

Catalog ID
STK483549
SMILES COC(=O)c1sccc1NC(=O)N1CCN(CC1)Cc1cc(Cl)ccc1OC

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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 C19H22ClN3O4S MW 423.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN3O4S/c1-26-16-4-3-14(20)11-13(16)12-22-6-8-23(9-7-22)19(25)21-15-5-10-28-17(15)18(24)27-2/h3-5,10-11H,6-9,12H2,1-2H3,(H,21,25)
InChIKey
MTKBQQHATXNCKT-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)Cl)CN2CCN(CC2)C(=O)NC3=C(SC=C3)C(=O)OC
InChI=1SC19H22ClN3O4Sc126164314(20)1113(16)12226823(9722)19(25)21155102817(15)18(24)272h351011H6912H212H3(H2125)
methyl3(((4(5chloro2methoxybenzyl)piperazin1yl)carbonyl)amino)thiophene2carboxylate
methyl3((4((5chloro2methoxyphenyl)methyl)piperazine1carbonyl)amino)thiophene2carboxylate
MFCD08593679
ZINC000013324494
ZINC13324494

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Available files

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