Vitas-M small molecule compound

methyl 2-[(1-benzofuran-2-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK947202
SMILES COC(=O)c1c(NC(=O)c2cc3c(o2)cccc3)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 C19H17NO4S MW 355.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO4S/c1-23-19(22)16-12-7-3-5-9-15(12)25-18(16)20-17(21)14-10-11-6-2-4-8-13(11)24-14/h2,4,6,8,10H,3,5,7,9H2,1H3,(H,20,21)
InChIKey
GALPBVGFXCNZOE-UHFFFAOYSA-N
Synonyms
868154-05-6
868154056
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC4=CC=CC=C4O3
InChI=1SC19H17NO4Sc12319(22)1612735915(12)2518(16)2017(21)141011624813(11)2414h246810H3579H21H3(H2021)
methyl2((1benzofuran2ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(1benzofuran2carbonylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD05885045
ZINC000002708307
ZINC02708307
ZINC2708307

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Available files

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