Vitas-M small molecule compound

methyl 2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK158435
SMILES COc1ccc(cc1)NC1=C(C(=O)CS1)C(=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 C13H13NO4S MW 279.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO4S/c1-17-9-5-3-8(4-6-9)14-12-11(13(16)18-2)10(15)7-19-12/h3-6,14H,7H2,1-2H3
InChIKey
IWFNISSZLNMENO-UHFFFAOYSA-N
Synonyms
430468-16-9
430468169
COC1=CC=C(C=C1)NC2=C(C(=O)CS2)C(=O)OC
InChI=1SC13H13NO4Sc1179538(469)141211(13(16)182)10(15)71912h3614H7H212H3
METHYL2((4METHOXYPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
METHYL2(4METHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
MFCD02924603
ZINC000000372053
ZINC00372053
ZINC372053

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Available files

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