Vitas-M small molecule compound
ethyl {[3-cyano-6-oxo-4-(3-phenoxyphenyl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK860541
SMILES CCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cccc(c1)Oc1ccccc1
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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 C22H20N2O4S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O4S/c1-2-27-21(26)14-29-22-19(13-23)18(12-20(25)24-22)15-7-6-10-17(11-15)28-16-8-4-3-5-9-16/h3-11,18H,2,12,14H2,1H3,(H,24,25)InChIKey
PIRIDQKQGVEKNU-UHFFFAOYSA-NSynonyms
330557-77-2330557772
CCOC(=O)CSC1=C(C(CC(=O)N1)C2=CC(=CC=C2)OC3=CC=CC=C3)C#N
ethyl((3cyano6oxo4(3phenoxyphenyl)1456tetrahydropyridin2yl)sulfanyl)acetate
ethyl2((3cyano6oxo4(3phenoxyphenyl)1456tetrahydropyridin2yl)thio)acetate
ETHYL2((5CYANO2OXO4(3PHENOXYPHENYL)34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
InChI=1SC22H20N2O4Sc122721(26)14292219(1323)18(1220(25)2422)15761017(1115)28168435916h31118H21214H21H3(H2425)
MFCD01464772
ZINC000009324699
ZINC000009324700
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