Vitas-M small molecule compound
ethyl (5Z)-5-[2-(benzyloxy)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK710269
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccccc2OCc2ccccc2)/C1=O
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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 C27H23NO4S MW 457.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO4S/c1-2-31-27(30)24-25(29)23(33-26(24)28-21-14-7-4-8-15-21)17-20-13-9-10-16-22(20)32-18-19-11-5-3-6-12-19/h3-17,28H,2,18H2,1H3/b23-17-InChIKey
RDWMATFWWCLKHO-QJOMJCCJSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccccc2OCc2ccccc2)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2OCC3=CC=CC=C3)C1=O)NC4=CC=CC=C4
ETHYL(5Z)2ANILINO4OXO5((2PHENYLMETHOXYPHENYL)METHYLIDENE)THIOPHENE3CARBOXYLATE
ethyl(5Z)5(2(benzyloxy)benzylidene)4oxo2(phenylamino)45dihydrothiophene3carboxylate
InChI=1SC27H23NO4Sc123127(30)2425(29)23(3326(24)2821147481521)1720139101622(20)321819115361219h31728H218H21H3b2317
MFCD03711599
ZINC000009295952
ZINC09295952
ZINC9295952
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