Vitas-M small molecule compound

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

Catalog ID
STL100344
SMILES COc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1ccsc1C(=O)OC

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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 C17H20N2O5S2 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O5S2/c1-23-14-5-3-4-13(12-14)18-7-9-19(10-8-18)26(21,22)15-6-11-25-16(15)17(20)24-2/h3-6,11-12H,7-10H2,1-2H3
InChIKey
DXAPKMCPNNKCFE-UHFFFAOYSA-N
Synonyms
438622-76-5
438622765
COC1=CC=CC(=C1)N2CCN(CC2)S(=O)(=O)C3=C(SC=C3)C(=O)OC
InChI=1SC17H20N2O5S2c1231453413(1214)187919(10818)26(2122)156112516(15)17(20)242h361112H710H212H3
methyl3((4(3methoxyphenyl)piperazin1yl)sulfonyl)thiophene2carboxylate
methyl3(4(3methoxyphenyl)piperazin1yl)sulfonylthiophene2carboxylate
MFCD02931919
ZINC000006915093
ZINC06915093
ZINC6915093

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Available files

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