Vitas-M small molecule compound
ethyl (5Z)-5-[(5-bromothiophen-2-yl)methylidene]-2-[(4-ethoxyphenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL374722
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OCC)S/C(=C\c2ccc(s2)Br)/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 C20H18BrNO4S2 MW 480.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrNO4S2/c1-3-25-13-7-5-12(6-8-13)22-19-17(20(24)26-4-2)18(23)15(28-19)11-14-9-10-16(21)27-14/h5-11,22H,3-4H2,1-2H3/b15-11-InChIKey
NOWCJJRJUPWGDW-PTNGSMBKSA-NSynonyms
CCOC(=O)C1=C(Nc2ccc(cc2)OCC)SC(=Cc2ccc(s2)Br)C1=O
CCOC1=CC=C(C=C1)NC2=C(C(=O)C(=CC3=CC=C(S3)Br)S2)C(=O)OCC
ethyl(5Z)5((5bromothiophen2yl)methylidene)2((4ethoxyphenyl)amino)4oxo45dihydrothiophene3carboxylate
ETHYL(5Z)5((5BROMOTHIOPHEN2YL)METHYLIDENE)2(4ETHOXYANILINO)4OXOTHIOPHENE3CARBOXYLATE
ETHYL5((5BROMO2THIENYL)METHYLENE)2(4ETHOXYANILINO)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC20H18BrNO4S2c1325137512(6813)221917(20(24)2642)18(23)15(2819)111491016(21)2714h51122H34H212H3b1511
MFCD02637629
ZINC000002972639
ZINC02972639
ZINC2972639
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