Vitas-M small molecule compound
ethyl 5-cyano-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827306
SMILES CCOC(=O)C1=C(NC(=C(C1c1cccs1)C#N)SCC(=O)OC)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 C22H20N2O4S2 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O4S2/c1-3-28-22(26)19-18(16-10-7-11-29-16)15(12-23)21(30-13-17(25)27-2)24-20(19)14-8-5-4-6-9-14/h4-11,18,24H,3,13H2,1-2H3InChIKey
UFZZBAGNDIWPJE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CS2)C#N)SCC(=O)OC)C3=CC=CC=C3
ethyl5cyano6((2methoxy2oxoethyl)sulfanyl)2phenyl4(thiophen2yl)14dihydropyridine3carboxylate
ethyl5cyano6(2methoxy2oxoethyl)sulfanyl2phenyl4thiophen2yl14dihydropyridine3carboxylate
InChI=1SC22H20N2O4S2c132822(26)1918(16107112916)15(1223)21(301317(25)272)2420(19)148546914h4111824H313H212H3
MFCD10087588
ZINC000020348238
ZINC000020348239
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