Vitas-M small molecule compound

ethyl (5Z)-5-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STL368900
SMILES C=CCOc1ccc(cc1OC)/C=C/1\SC(=C(C1=O)C(=O)OCC)Nc1ccccc1

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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 C24H23NO5S MW 437.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO5S/c1-4-13-30-18-12-11-16(14-19(18)28-3)15-20-22(26)21(24(27)29-5-2)23(31-20)25-17-9-7-6-8-10-17/h4,6-12,14-15,25H,1,5,13H2,2-3H3/b20-15-
InChIKey
TWLUYLVVDQCQEG-HKWRFOASSA-N
Synonyms

C=CCOc1ccc(cc1OC)C=C1SC(=C(C1=O)C(=O)OCC)Nc1ccccc1
CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OCC=C)OC)C1=O)NC3=CC=CC=C3
ETHYL(5Z)2ANILINO5((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(3methoxy4(prop2en1yloxy)benzylidene)4oxo2(phenylamino)45dihydrothiophene3carboxylate
InChI=1SC24H23NO5Sc14133018121116(1419(18)283)152022(26)21(24(27)2952)23(3120)251797681017h4612141525H1513H223H3b2015
MFCD05039732
ZINC000009295784
ZINC09295784
ZINC9295784

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Available files

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