Vitas-M small molecule compound
ethyl (5Z)-5-[2-(2-methoxy-2-oxoethoxy)benzylidene]-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL371517
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccccc2OCC(=O)OC)/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 C23H21NO6S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21NO6S/c1-3-29-23(27)20-21(26)18(31-22(20)24-16-10-5-4-6-11-16)13-15-9-7-8-12-17(15)30-14-19(25)28-2/h4-13,24H,3,14H2,1-2H3/b18-13-InChIKey
QTPBQECHJJMGGY-AQTBWJFISA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccccc2OCC(=O)OC)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CC=C2OCC(=O)OC)C1=O)NC3=CC=CC=C3
ETHYL(5Z)2ANILINO5((2(2METHOXY2OXOETHOXY)PHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(2(2methoxy2oxoethoxy)benzylidene)4oxo2(phenylamino)45dihydrothiophene3carboxylate
InChI=1SC23H21NO6Sc132923(27)2021(26)18(3122(20)2416105461116)13159781217(15)301419(25)282h41324H314H212H3b1813
MFCD03269845
ZINC000008395910
ZINC08395910
ZINC8395910
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