Vitas-M small molecule compound
ethyl 2-[({[3-cyano-6-methyl-4-(thiophen-3-yl)-5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl]sulfanyl}acetyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK997301
SMILES CCOC(=O)c1c(NC(=O)CSc2nc3CCN(Cc3c(c2C#N)c2ccsc2)C)sc2c1CCC2
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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 C26H26N4O3S3 MW 538.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S3/c1-3-33-26(32)23-16-5-4-6-20(16)36-25(23)29-21(31)14-35-24-17(11-27)22(15-8-10-34-13-15)18-12-30(2)9-7-19(18)28-24/h8,10,13H,3-7,9,12,14H2,1-2H3,(H,29,31)InChIKey
HHEVXONYNPFMCJ-UHFFFAOYSA-NSynonyms
445383-38-0445383380
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CSC3=NC4=C(CN(CC4)C)C(=C3C#N)C5=CSC=C5
ethyl2((((3cyano6methyl4(thiophen3yl)5678tetrahydro16naphthyridin2yl)sulfanyl)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((2((3CYANO6METHYL4THIOPHEN3YL78DIHYDRO5H16NAPHTHYRIDIN2YL)SULFANYL)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ethyl2(2((3cyano6methyl4(thiophen3yl)5678tetrahydro16naphthyridin2yl)thio)acetamido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC26H26N4O3S3c133326(32)231654620(16)3625(23)2921(31)14352417(1127)22(15810341315)181230(2)9719(18)2824h81013H3791214H212H3(H2931)
MFCD03234595
ZINC000097940203
ZINC97940203
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