Vitas-M small molecule compound
ethyl (5Z)-5-[3-iodo-5-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-{[(2-methylphenyl)carbonyl]amino}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL380539
SMILES C=CCOc1c(I)cc(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 C26H24INO6S MW 605.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24INO6S/c1-5-11-34-23-18(27)12-16(13-19(23)32-4)14-20-22(29)21(26(31)33-6-2)25(35-20)28-24(30)17-10-8-7-9-15(17)3/h5,7-10,12-14H,1,6,11H2,2-4H3,(H,28,30)/b20-14-InChIKey
QYRYCZZQZRACKP-ZHZULCJRSA-NSynonyms
C=CCOc1c(I)cc(cc1OC)C=C1SC(=C(C1=O)C(=O)OCC)NC(=O)c1ccccc1C
CCOC(=O)C1=C(SC(=CC2=CC(=C(C(=C2)I)OCC=C)OC)C1=O)NC(=O)C3=CC=CC=C3C
ETHYL(5Z)5((3IODO5METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2((2METHYLBENZOYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(3iodo5methoxy4(prop2en1yloxy)benzylidene)2(((2methylphenyl)carbonyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL5(4(ALLYLOXY)3IODO5METHOXYBENZYLIDENE)2((2METHYLBENZOYL)AMINO)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC26H24INO6Sc1511342318(27)1216(1319(23)324)142022(29)21(26(31)3362)25(3520)2824(30)171087915(17)3h57101214H1611H224H3(H2830)b2014
MFCD03783983
ZINC000008396239
ZINC08396239
ZINC8396239
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.