Vitas-M small molecule compound
ethyl 5-({[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]acetyl}amino)-4-cyano-3-methylthiophene-2-carboxylate
Catalog ID
STL368396
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nnc(o1)Cc1ccccc1
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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 C20H18N4O4S2 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S2/c1-3-27-19(26)17-12(2)14(10-21)18(30-17)22-15(25)11-29-20-24-23-16(28-20)9-13-7-5-4-6-8-13/h4-8H,3,9,11H2,1-2H3,(H,22,25)InChIKey
XTDMSJJFEQHMRK-UHFFFAOYSA-NSynonyms
4CYANO3METHYL5((1OXO2((5(PHENYLMETHYL)134OXADIAZOL2YL)THIO)ETHYL)AMINO)2THIOPHENECARBOXYLICACIDETHYLESTER
5((2((5BENZYL134OXADIAZOL2YL)THIO)ACETYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=NN=C(O2)CC3=CC=CC=C3)C#N)C
ETHYL4CYANO3METHYL5(2((5(PHENYLMETHYL)134OXADIAZOL2YL)SULFANYL)ETHANOYLAMINO)THIOPHENE2CARBOXYLATE
ethyl5((((5benzyl134oxadiazol2yl)sulfanyl)acetyl)amino)4cyano3methylthiophene2carboxylate
ETHYL5((((5BENZYL134OXADIAZOL2YL)THIO)ACETYL)AMINO)4CYANO3METHYL2THIOPHENECARBOXYLATE
ETHYL5((2((5BENZYL134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC20H18N4O4S2c132719(26)1712(2)14(1021)18(3017)2215(25)112920242316(2820)9137546813h48H3911H212H3(H2225)
MFCD05841699
ZINC000002869596
ZINC02869596
ZINC2869596
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