Vitas-M small molecule compound
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK886212
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)N)c1ccccc1
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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 C21H19N3O4S MW 409.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4S/c1-2-27-21(26)18-17(15-9-6-10-28-15)14(11-22)20(29-12-16(23)25)24-19(18)13-7-4-3-5-8-13/h3-10,17,24H,2,12H2,1H3,(H2,23,25)InChIKey
LDJCDDVCPMZYFN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)N)C3=CC=CC=C3
ethyl6((2amino2oxoethyl)sulfanyl)5cyano4(furan2yl)2phenyl14dihydropyridine3carboxylate
ETHYL6(2AMINO2OXOETHYL)SULFANYL5CYANO4(FURAN2YL)2PHENYL14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC21H19N3O4Sc122721(26)1817(1596102815)14(1122)20(291216(23)25)2419(18)137435813h3101724H212H21H3(H22325)
MFCD05033545
ZINC000020136807
ZINC000020136811
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