Vitas-M small molecule compound

ethyl 2-[(2-hydroxy-5-methoxybenzyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK005605
SMILES CCOC(=O)c1c(NCc2cc(OC)ccc2O)sc2c1CCCC2

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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 C19H23NO4S MW 361.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO4S/c1-3-24-19(22)17-14-6-4-5-7-16(14)25-18(17)20-11-12-10-13(23-2)8-9-15(12)21/h8-10,20-21H,3-7,11H2,1-2H3
InChIKey
LRODEYUUCRMODW-UHFFFAOYSA-N
Synonyms
380644-32-6
380644326
CCOC(=O)C1=C(SC2=C1CCCC2)NCC3=C(C=CC(=C3)OC)O
CCOC(=O)c1c(NCc2cc(OC)ccc2O)sc2c1CCCC2
ethyl2((2hydroxy5methoxybenzyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2hydroxy5methoxybenzyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl2((2hydroxy5methoxyphenyl)methylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H23NO4Sc132419(22)1714645716(14)2518(17)2011121013(232)8915(12)21h8102021H3711H212H3
MFCD02942862
STK005605
ZINC000000708900
ZINC00708900
ZINC708900

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Available files

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