Vitas-M small molecule compound
ethyl 5-acetyl-2-({[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STL368398
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(o2)Cc2ccccc2)sc(c1C)C(=O)C
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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 C21H21N3O5S2 MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O5S2/c1-4-28-20(27)17-12(2)18(13(3)25)31-19(17)22-15(26)11-30-21-24-23-16(29-21)10-14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H,22,26)InChIKey
IBACQXJFFGAPMH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CSC2=NN=C(O2)CC3=CC=CC=C3
ethyl5acetyl2((((5benzyl134oxadiazol2yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
ETHYL5ACETYL2((((5BENZYL134OXADIAZOL2YL)THIO)ACETYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
ETHYL5ACETYL2((2((5BENZYL134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H21N3O5S2c142820(27)1712(2)18(13(3)25)3119(17)2215(26)113021242316(2921)10148657914h59H41011H213H3(H2226)
MFCD05841883
ZINC000002876981
ZINC02876981
ZINC2876981
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