Vitas-M small molecule compound

ethyl 2-{[(3-chloro-4-methoxyphenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STL114371
SMILES CCOC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccc(c(c1)Cl)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 C18H20ClNO5S2 MW 429.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClNO5S2/c1-3-25-18(21)16-12-6-4-5-7-15(12)26-17(16)20-27(22,23)11-8-9-14(24-2)13(19)10-11/h8-10,20H,3-7H2,1-2H3
InChIKey
RRUTVPBCJQKLRP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC(=C(C=C3)OC)Cl
ethyl2(((3chloro4methoxyphenyl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3chloro4methoxyphenyl)sulfonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC18H20ClNO5S2c132518(21)1612645715(12)2617(16)2027(2223)118914(242)13(19)1011h81020H37H212H3
MFCD05836621
ZINC000006480559
ZINC6480559

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Available files

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