Vitas-M small molecule compound
2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-(3-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK840771
SMILES Cc1cccc(c1)n1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCCc1s2
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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 C24H20N2O3S2 MW 448.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O3S2/c1-14-4-2-5-16(10-14)26-23(27)21-17-6-3-7-20(17)31-22(21)25-24(26)30-12-15-8-9-18-19(11-15)29-13-28-18/h2,4-5,8-11H,3,6-7,12-13H2,1H3InChIKey
QXFIRZNFFIJUAF-UHFFFAOYSA-NSynonyms
384368-88-12((13benzodioxol5ylmethyl)sulfanyl)3(3methylphenyl)3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin4one
2((benzo(d)(13)dioxol5ylmethyl)thio)3(mtolyl)67dihydro3Hcyclopenta(45)thieno(23d)pyrimidin4(5H)one
3(13benzodioxol5ylmethylsulfanyl)2(3methylphenyl)78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin1one
384368881
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC4=CC5=C(C=C4)OCO5)SC6=C3CCC6
InChI=1SC24H20N2O3S2c11442516(1014)2623(27)211763720(17)3122(21)2524(26)301215891819(1115)29132818h245811H3671213H21H3
MFCD03284767
ZINC000001131369
ZINC01131369
ZINC1131369
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