Vitas-M small molecule compound

methyl 2-{[(4-propoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK730744
SMILES CCCOc1ccc(cc1)C(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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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 C20H23NO4S MW 373.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO4S/c1-3-12-25-14-10-8-13(9-11-14)18(22)21-19-17(20(23)24-2)15-6-4-5-7-16(15)26-19/h8-11H,3-7,12H2,1-2H3,(H,21,22)
InChIKey
NRHTXTLMINWJIU-UHFFFAOYSA-N
Synonyms

CCCOC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC
InChI=1SC20H23NO4Sc1312251410813(91114)18(22)211917(20(23)242)15645716(15)2619h811H3712H212H3(H2122)
methyl2(((4propoxyphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((4propoxybenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD04208741
ZINC000002960629
ZINC02960629
ZINC2960629

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Available files

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