Vitas-M small molecule compound

ethyl 4-cyano-3-methyl-5-[({[5-(pyridin-4-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetyl)amino]thiophene-2-carboxylate

Catalog ID
STL505090
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nnc(o1)c1ccncc1

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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 C18H15N5O4S2 MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O4S2/c1-3-26-17(25)14-10(2)12(8-19)16(29-14)21-13(24)9-28-18-23-22-15(27-18)11-4-6-20-7-5-11/h4-7H,3,9H2,1-2H3,(H,21,24)
InChIKey
NLCYXOPDBUWPBC-UHFFFAOYSA-N
Synonyms

3688848
ETHYL4CYANO3METHYL5((((5(4PYRIDINYL)134OXADIAZOL2YL)THIO)ACETYL)AMINO)2THIOPHENECARBOXYLATE
ethyl4cyano3methyl5((((5(pyridin4yl)134oxadiazol2yl)sulfanyl)acetyl)amino)thiophene2carboxylate
ETHYL4CYANO3METHYL5((2((5PYRIDIN4YL134OXADIAZOL2YL)SULFANYL)ACETYL)AMINO)THIOPHENE2CARBOXYLATE
InChI=1SC18H15N5O4S2c132617(25)1410(2)12(819)16(2914)2113(24)92818232215(2718)1146207511h47H39H212H3(H2124)
MFCD04149599
ZINC000008430414
ZINC8430414

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Available files

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