Vitas-M small molecule compound

methyl 5-chloro-3-{[4-(2-methoxyphenyl)piperazin-1-yl]sulfonyl}thiophene-2-carboxylate

Catalog ID
STK933042
SMILES COC(=O)c1sc(cc1S(=O)(=O)N1CCN(CC1)c1ccccc1OC)Cl

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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 C17H19ClN2O5S2 MW 430.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN2O5S2/c1-24-13-6-4-3-5-12(13)19-7-9-20(10-8-19)27(22,23)14-11-15(18)26-16(14)17(21)25-2/h3-6,11H,7-10H2,1-2H3
InChIKey
QKEGKLFNAGECFC-UHFFFAOYSA-N
Synonyms
1212060-56-4
1212060564
COC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(SC(=C3)Cl)C(=O)OC
InChI=1SC17H19ClN2O5S2c12413643512(13)197920(10819)27(2223)141115(18)2616(14)17(21)252h3611H710H212H3
methyl5chloro3((4(2methoxyphenyl)piperazin1yl)sulfonyl)thiophene2carboxylate
methyl5chloro3(4(2methoxyphenyl)piperazin1yl)sulfonylthiophene2carboxylate
MFCD15147648
ZINC000044893440
ZINC44893440

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Available files

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