Vitas-M small molecule compound
2-(benzylsulfanyl)-6-ethyl-6-methyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831195
SMILES CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCc1ccccc1
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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 C25H24N2O2S2 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O2S2/c1-3-25(2)14-19-20(15-29-25)31-22-21(19)23(28)27(18-12-8-5-9-13-18)24(26-22)30-16-17-10-6-4-7-11-17/h4-13H,3,14-16H2,1-2H3InChIKey
HCESPOOFZSIYOH-UHFFFAOYSA-NSynonyms
4595-86-22(benzylsulfanyl)6ethyl6methyl3phenyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2(benzylthio)6ethyl6methyl3phenyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2benzylsulfanyl6ethyl6methyl3phenyl58dihydropyrano(23)thieno(24b)pyrimidin4one
4595862
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4)C5=CC=CC=C5)C
InChI=1SC25H24N2O2S2c1325(2)141920(152925)312221(19)23(28)27(18128591318)24(2622)301617106471117h413H31416H212H3
MFCD01557992
ZINC000002208293
ZINC000002208296
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