Vitas-M small molecule compound
ethyl (5Z)-5-(2,4-diethoxybenzylidene)-2-[(4-ethoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL374730
SMILES CCOc1ccc(cc1)NC1=C(C(=O)OCC)C(=O)/C(=C/c2ccc(cc2OCC)OCC)/S1
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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 C26H29NO6S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6S/c1-5-30-19-13-10-18(11-14-19)27-25-23(26(29)33-8-4)24(28)22(34-25)15-17-9-12-20(31-6-2)16-21(17)32-7-3/h9-16,27H,5-8H2,1-4H3/b22-15-InChIKey
OETHRHQQPGNUIF-JCMHNJIXSA-NSynonyms
CCOC1=CC=C(C=C1)NC2=C(C(=O)C(=CC3=C(C=C(C=C3)OCC)OCC)S2)C(=O)OCC
CCOc1ccc(cc1)NC1=C(C(=O)OCC)C(=O)C(=Cc2ccc(cc2OCC)OCC)S1
ETHYL(5Z)5((24DIETHOXYPHENYL)METHYLIDENE)2(4ETHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(24diethoxybenzylidene)2((4ethoxyphenyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL5(24DIETHOXYBENZYLIDENE)2(4ETHOXYANILINO)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC26H29NO6Sc153019131018(111419)272523(26(29)3384)24(28)22(3425)151791220(3162)1621(17)3273h91627H58H214H3b2215
MFCD02637301
ZINC000002971464
ZINC02971464
ZINC2971464
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