Vitas-M small molecule compound
ethyl (5Z)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-[(4-methoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK387690
SMILES C=CCOc1ccc(cc1OCC)/C=C/1\SC(=C(C1=O)C(=O)OCC)Nc1ccc(cc1)OC
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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 C26H27NO6S MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27NO6S/c1-5-14-33-20-13-8-17(15-21(20)31-6-2)16-22-24(28)23(26(29)32-7-3)25(34-22)27-18-9-11-19(30-4)12-10-18/h5,8-13,15-16,27H,1,6-7,14H2,2-4H3/b22-16-InChIKey
DVDVCQMZNPIBDZ-JWGURIENSA-NSynonyms
C=CCOc1ccc(cc1OCC)C=C1SC(=C(C1=O)C(=O)OCC)Nc1ccc(cc1)OC
CCOC1=C(C=CC(=C1)C=C2C(=O)C(=C(S2)NC3=CC=C(C=C3)OC)C(=O)OCC)OCC=C
ETHYL(5Z)5((3ETHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2(4METHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(3ETHOXY4(PROP2EN1YLOXY)BENZYLIDENE)2((4METHOXYPHENYL)AMINO)4OXO45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL5((3ETHOXY4PROP2ENYLOXYPHENYL)METHYLENE)2((4METHOXYPHENYL)AMINO)4OXOTHIOPHENE3CARBOXYLATE
InChI=1SC26H27NO6Sc1514332013817(1521(20)3162)162224(28)23(26(29)3273)25(3422)271891119(304)121018h5813151627H16714H224H3b2216
MFCD02787437
ZINC000004082077
ZINC04082077
ZINC4082077
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