Vitas-M small molecule compound
ethyl 5-cyano-6-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827300
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)NC1CCCC1)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/c1-2-32-26(31)23-22(20-13-8-14-33-20)19(15-27)25(29-24(23)17-9-4-3-5-10-17)34-16-21(30)28-18-11-6-7-12-18/h3-5,8-10,13-14,18,22,29H,2,6-7,11-12,16H2,1H3,(H,28,30)InChIKey
VJADRKYOSKCRKF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3CCCC3)C4=CC=CC=C4
ethyl5cyano6((2(cyclopentylamino)2oxoethyl)sulfanyl)4(furan2yl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano6(2(cyclopentylamino)2oxoethyl)sulfanyl4(furan2yl)2phenyl14dihydropyridine3carboxylate
InChI=1SC26H27N3O4Sc123226(31)2322(20138143320)19(1527)25(2924(23)1794351017)341621(30)281811671218h358101314182229H267111216H21H3(H2830)
MFCD10574653
ZINC000020348207
ZINC000020348208
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