Vitas-M small molecule compound
ethyl (5Z)-5-[2-(benzyloxy)benzylidene]-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL374995
SMILES CCOC(=O)C1=C(NC(=O)c2ccccc2)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 C28H23NO5S MW 485.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO5S/c1-2-33-28(32)24-25(30)23(35-27(24)29-26(31)20-13-7-4-8-14-20)17-21-15-9-10-16-22(21)34-18-19-11-5-3-6-12-19/h3-17H,2,18H2,1H3,(H,29,31)/b23-17-InChIKey
AZSAVEWSGJCPGZ-QJOMJCCJSA-NSynonyms
CCOC(=O)C1=C(NC(=O)c2ccccc2)SC(=Cc2ccccc2OCc2ccccc2)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2OCC3=CC=CC=C3)C1=O)NC(=O)C4=CC=CC=C4
ETHYL(5Z)2BENZAMIDO4OXO5((2PHENYLMETHOXYPHENYL)METHYLIDENE)THIOPHENE3CARBOXYLATE
ethyl(5Z)5(2(benzyloxy)benzylidene)4oxo2((phenylcarbonyl)amino)45dihydrothiophene3carboxylate
InChI=1SC28H23NO5Sc123328(32)2425(30)23(3527(24)2926(31)20137481420)1721159101622(21)341819115361219h317H218H21H3(H2931)b2317
MFCD03720008
ZINC000009296115
ZINC09296115
ZINC9296115
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