Vitas-M small molecule compound
ethyl (5Z)-2-[(4-ethoxyphenyl)amino]-5-[2-(2-methoxy-2-oxoethoxy)benzylidene]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL374733
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OCC)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 C25H25NO7S MW 483.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO7S/c1-4-31-18-12-10-17(11-13-18)26-24-22(25(29)32-5-2)23(28)20(34-24)14-16-8-6-7-9-19(16)33-15-21(27)30-3/h6-14,26H,4-5,15H2,1-3H3/b20-14-InChIKey
CGGVVDJGLBBOJK-ZHZULCJRSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)OCC)SC(=Cc2ccccc2OCC(=O)OC)C1=O
CCOC1=CC=C(C=C1)NC2=C(C(=O)C(=CC3=CC=CC=C3OCC(=O)OC)S2)C(=O)OCC
ethyl(5Z)2((4ethoxyphenyl)amino)5(2(2methoxy2oxoethoxy)benzylidene)4oxo45dihydrothiophene3carboxylate
ETHYL(5Z)2(4ETHOXYANILINO)5((2(2METHOXY2OXOETHOXY)PHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL2(4ETHOXYANILINO)5(2(2METHOXY2OXOETHOXY)BENZYLIDENE)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC25H25NO7Sc143118121017(111318)262422(25(29)3252)23(28)20(3424)1416867919(16)331521(27)303h61426H4515H213H3b2014
MFCD02636757
ZINC000002969043
ZINC02969043
ZINC2969043
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