Vitas-M small molecule compound

ethyl (5E)-5-benzylidene-2-(naphthalen-1-ylamino)-4-oxo-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK064447
SMILES CCOC(=O)C1=C(S/C(=C/c2ccccc2)/C1=O)Nc1cccc2c1cccc2

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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 C24H19NO3S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19NO3S/c1-2-28-24(27)21-22(26)20(15-16-9-4-3-5-10-16)29-23(21)25-19-14-8-12-17-11-6-7-13-18(17)19/h3-15,25H,2H2,1H3/b20-15+
InChIKey
HROKAEJVPCLXHR-HMMYKYKNSA-N
Synonyms

CCOC(=O)C1=C(SC(=CC2=CC=CC=C2)C1=O)NC3=CC=CC4=CC=CC=C43
CCOC(=O)C1=C(SC(=Cc2ccccc2)C1=O)Nc1cccc2c1cccc2
ETHYL(5E)5BENZYLIDENE2(NAPHTHALEN1YLAMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5E)5BENZYLIDENE2(NAPHTHALEN1YLAMINO)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC24H19NO3Sc122824(27)2122(26)20(151694351016)2923(21)2519148121711671318(17)19h31525H2H21H3b2015+
MFCD08051685
STK064447
ZINC000002903921
ZINC02903921
ZINC2903921

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Available files

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