Vitas-M small molecule compound
3-benzyl-2-{[1-(morpholin-4-yl)-1-oxopropan-2-yl]sulfanyl}-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK539688
SMILES CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)Cc1ccccc1)SC(C(=O)N1CCOCC1)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 C26H31N3O4S2 MW 513.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4S2/c1-16(2)20-13-19-21(15-33-20)35-23-22(19)25(31)29(14-18-7-5-4-6-8-18)26(27-23)34-17(3)24(30)28-9-11-32-12-10-28/h4-8,16-17,20H,9-15H2,1-3H3InChIKey
UOFDCGQSHZZYST-UHFFFAOYSA-NSynonyms
384367-62-8384367628
3benzyl2((1(morpholin4yl)1oxopropan2yl)sulfanyl)6(propan2yl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
3benzyl2(1morpholin4yl1oxopropan2yl)sulfanyl6propan2yl68dihydro5Hpyrano(23)thieno(24b)pyrimidin4one
3benzyl6isopropyl2((1morpholino1oxopropan2yl)thio)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
CC(C)C1CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SC(C)C(=O)N4CCOCC4)CC5=CC=CC=C5
InChI=1SC26H31N3O4S2c116(2)20131921(153320)352322(19)25(31)29(14187546818)26(2723)3417(3)24(30)2891132121028h48161720H915H213H3
MFCD03284687
ZINC000001239977
ZINC000001239980
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