Vitas-M small molecule compound
ethyl 5-cyano-6-{[2-(2-methylpropoxy)-2-oxoethyl]sulfanyl}-2-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxylate
Catalog ID
STK886871
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccncc1)C#N)SCC(=O)OCC(C)C)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 C26H27N3O4S MW 477.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O4S/c1-4-32-26(31)23-22(18-10-12-28-13-11-18)20(14-27)25(34-16-21(30)33-15-17(2)3)29-24(23)19-8-6-5-7-9-19/h5-13,17,22,29H,4,15-16H2,1-3H3InChIKey
FQRVSAVNSINQSQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=NC=C2)C#N)SCC(=O)OCC(C)C)C3=CC=CC=C3
ethyl5cyano6((2(2methylpropoxy)2oxoethyl)sulfanyl)2phenyl14dihydro44bipyridine3carboxylate
ethyl5cyano6(2(2methylpropoxy)2oxoethyl)sulfanyl2phenyl4pyridin4yl14dihydropyridine3carboxylate
InChI=1SC26H27N3O4Sc143226(31)2322(18101228131118)20(1427)25(341621(30)331517(2)3)2924(23)198657919h513172229H41516H213H3
MFCD10087500
ZINC000020348179
ZINC000020348180
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