Vitas-M small molecule compound
ethyl 2-[(4-chlorobenzyl)sulfanyl]-3-cyano-6-ethyl-5,6,7,8-tetrahydro-1,6-naphthyridine-4-carboxylate
Catalog ID
STL297799
SMILES CCOC(=O)c1c(C#N)c(SCc2ccc(cc2)Cl)nc2c1CN(CC)CC2
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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 C21H22ClN3O2S MW 415.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O2S/c1-3-25-10-9-18-17(12-25)19(21(26)27-4-2)16(11-23)20(24-18)28-13-14-5-7-15(22)8-6-14/h5-8H,3-4,9-10,12-13H2,1-2H3InChIKey
POGPRMCMUBHLMU-UHFFFAOYSA-NSynonyms
340817-52-9340817529
CCN1CCC2=C(C1)C(=C(C(=N2)SCC3=CC=C(C=C3)Cl)C#N)C(=O)OCC
ethyl2((4chlorobenzyl)sulfanyl)3cyano6ethyl5678tetrahydro16naphthyridine4carboxylate
ethyl2((4chlorobenzyl)thio)3cyano6ethyl5678tetrahydro16naphthyridine4carboxylate
ETHYL2((4CHLOROPHENYL)METHYLSULFANYL)3CYANO6ETHYL78DIHYDRO5H16NAPHTHYRIDINE4CARBOXYLATE
InChI=1SC21H22ClN3O2Sc13251091817(1225)19(21(26)2742)16(1123)20(2418)2813145715(22)8614h58H349101213H212H3
MFCD01416745
ZINC000020813725
ZINC20813725
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