Vitas-M small molecule compound
2-{[3-cyclohexyl-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK547755
SMILES O=C(Nc1ccccc1)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)C(C)C
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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 C26H31N3O3S2 MW 497.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O3S2/c1-16(2)20-13-19-21(14-32-20)34-24-23(19)25(31)29(18-11-7-4-8-12-18)26(28-24)33-15-22(30)27-17-9-5-3-6-10-17/h3,5-6,9-10,16,18,20H,4,7-8,11-15H2,1-2H3,(H,27,30)InChIKey
XKBIZTZLAADHED-UHFFFAOYSA-NSynonyms
799826-45-22((3cyclohexyl4oxo6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)Nphenylacetamide
2((3cyclohexyl4oxo6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)Nphenylacetamide
2((3cyclohexyl6isopropyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)Nphenylacetamide
799826452
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4)C5CCCCC5
InChI=1SC26H31N3O3S2c116(2)20131921(143220)342423(19)25(31)29(18117481218)26(2824)331522(30)271795361017h356910161820H4781115H212H3(H2730)
MFCD03683374
ZINC000002239650
ZINC000002239651
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