Vitas-M small molecule compound
ethyl 5-cyano-4-(furan-2-yl)-6-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK827299
SMILES CCOC(=O)C1=C(NC(=C(C1c1ccco1)C#N)SCC(=O)NCCC(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 C26H29N3O4S MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4S/c1-4-32-26(31)23-22(20-11-8-14-33-20)19(15-27)25(29-24(23)18-9-6-5-7-10-18)34-16-21(30)28-13-12-17(2)3/h5-11,14,17,22,29H,4,12-13,16H2,1-3H3,(H,28,30)InChIKey
WZGIEMJTWLYVDF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NCCC(C)C)C3=CC=CC=C3
ethyl5cyano4(furan2yl)6((2((3methylbutyl)amino)2oxoethyl)sulfanyl)2phenyl14dihydropyridine3carboxylate
ethyl5cyano4(furan2yl)6(2(3methylbutylamino)2oxoethyl)sulfanyl2phenyl14dihydropyridine3carboxylate
InChI=1SC26H29N3O4Sc143226(31)2322(20118143320)19(1527)25(2924(23)1896571018)341621(30)28131217(2)3h51114172229H4121316H213H3(H2830)
MFCD10087578
ZINC000020348203
ZINC000020348205
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