Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK831479
SMILES O=c1c2c(sc3c2CC(C)(C)OC3)nc(n1c1ccccc1)SCc1ccc2c(c1)OCO2
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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 C25H22N2O4S2 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O4S2/c1-25(2)11-17-20(12-31-25)33-22-21(17)23(28)27(16-6-4-3-5-7-16)24(26-22)32-13-15-8-9-18-19(10-15)30-14-29-18/h3-10H,11-14H2,1-2H3InChIKey
DELCYUBNPUWPFV-UHFFFAOYSA-NSynonyms
2((13benzodioxol5ylmethyl)sulfanyl)66dimethyl3phenyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
2((benzo(d)(13)dioxol5ylmethyl)thio)66dimethyl3phenyl56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2(13benzodioxol5ylmethylsulfanyl)66dimethyl3phenyl58dihydropyrano(23)thieno(24b)pyrimidin4one
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6)C
InChI=1SC25H22N2O4S2c125(2)111720(123125)332221(17)23(28)27(166435716)24(2622)321315891819(1015)30142918h310H1114H212H3
MFCD02241633
ZINC000000985905
ZINC00985905
ZINC985905
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