Vitas-M small molecule compound

ethyl 2-[({[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STL417487
SMILES CCOC(=O)c1c(NC(=O)CSc2nnc(o2)c2ccc(cc2)Cl)sc(c1C)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 C19H18ClN3O4S2 MW 451.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O4S2/c1-4-26-18(25)15-10(2)11(3)29-17(15)21-14(24)9-28-19-23-22-16(27-19)12-5-7-13(20)8-6-12/h5-8H,4,9H2,1-3H3,(H,21,24)
InChIKey
YAICGWYRINBJNG-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CSC2=NN=C(O2)C3=CC=C(C=C3)Cl
ethyl2((((5(4chlorophenyl)134oxadiazol2yl)sulfanyl)acetyl)amino)45dimethylthiophene3carboxylate
ETHYL2((2((5(4CHLOROPHENYL)134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
InChI=1SC19H18ClN3O4S2c142618(25)1510(2)11(3)2917(15)2114(24)92819232216(2719)125713(20)8612h58H49H213H3(H2124)
MFCD05812595
ZINC000001073079
ZINC01073079
ZINC1073079

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.