Vitas-M small molecule compound
ethyl 4-cyano-5-[({[5-(2-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]-3-methylthiophene-2-carboxylate
Catalog ID
STL445313
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nnc(o1)c1ccccc1OCC
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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 C21H20N4O5S2 MW 472.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5S2/c1-4-28-15-9-7-6-8-13(15)18-24-25-21(30-18)31-11-16(26)23-19-14(10-22)12(3)17(32-19)20(27)29-5-2/h6-9H,4-5,11H2,1-3H3,(H,23,26)InChIKey
PBYIWJHFGIBIIE-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2=NN=C(O2)SCC(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C#N
ethyl4cyano5((((5(2ethoxyphenyl)134oxadiazol2yl)sulfanyl)acetyl)amino)3methylthiophene2carboxylate
ETHYL4CYANO5((2((5(2ETHOXYPHENYL)134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC21H20N4O5S2c142815976813(15)18242521(3018)311116(26)231914(1022)12(3)17(3219)20(27)2952h69H4511H213H3(H2326)
MFCD05841731
ZINC000002891232
ZINC02891232
ZINC2891232
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