Vitas-M small molecule compound
prop-2-en-1-yl 5-cyano-6-{[2-(diethylamino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK885752
SMILES C=CCOC(=O)C1=C(C)NC(=C(C1c1ccco1)C#N)SCC(=O)N(CC)CC
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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 C21H25N3O4S MW 415.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O4S/c1-5-10-28-21(26)18-14(4)23-20(29-13-17(25)24(6-2)7-3)15(12-22)19(18)16-9-8-11-27-16/h5,8-9,11,19,23H,1,6-7,10,13H2,2-4H3InChIKey
JNYMAFJWWRAFIQ-UHFFFAOYSA-NSynonyms
796880-19-8796880198
allyl5cyano6((2(diethylamino)2oxoethyl)thio)4(furan2yl)2methyl14dihydropyridine3carboxylate
CCN(CC)C(=O)CSC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=CO2)C#N
InChI=1SC21H25N3O4Sc15102821(26)1814(4)2320(291317(25)24(62)73)15(1222)19(18)1698112716h589111923H1671013H224H3
MFCD03670122
prop2en1yl5cyano6((2(diethylamino)2oxoethyl)sulfanyl)4(furan2yl)2methyl14dihydropyridine3carboxylate
PROP2ENYL5CYANO6(2(DIETHYLAMINO)2OXOETHYL)SULFANYL4(FURAN2YL)2METHYL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000100935729
ZINC000100935731
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