Vitas-M small molecule compound
ethyl (5Z)-5-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-{[(2-methylphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL375009
SMILES C=CCOc1ccc(cc1OC)/C=C/1\SC(=C(C1=O)C(=O)OCC)NC(=O)c1ccccc1C
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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 C26H25NO6S MW 479.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25NO6S/c1-5-13-33-19-12-11-17(14-20(19)31-4)15-21-23(28)22(26(30)32-6-2)25(34-21)27-24(29)18-10-8-7-9-16(18)3/h5,7-12,14-15H,1,6,13H2,2-4H3,(H,27,29)/b21-15-InChIKey
AWNMUKGQSXMQFA-QNGOZBTKSA-NSynonyms
C=CCOc1ccc(cc1OC)C=C1SC(=C(C1=O)C(=O)OCC)NC(=O)c1ccccc1C
CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OCC=C)OC)C1=O)NC(=O)C3=CC=CC=C3C
ETHYL(5Z)5((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2((2METHYLBENZOYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(3methoxy4(prop2en1yloxy)benzylidene)2(((2methylphenyl)carbonyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL5(4(ALLYLOXY)3METHOXYBENZYLIDENE)2((2METHYLBENZOYL)AMINO)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC26H25NO6Sc15133319121117(1420(19)314)152123(28)22(26(30)3262)25(3421)2724(29)181087916(18)3h57121415H1613H224H3(H2729)b2115
MFCD03784005
ZINC000008396273
ZINC08396273
ZINC8396273
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