Vitas-M small molecule compound
7-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Catalog ID
STK542066
SMILES c1ccc(cc1)c1nc2sc3c(c2c2c1CCC2)ncnc3SCc1ccc2c(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 C26H19N3O2S2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O2S2/c1-2-5-16(6-3-1)22-18-8-4-7-17(18)21-23-24(33-25(21)29-22)26(28-13-27-23)32-12-15-9-10-19-20(11-15)31-14-30-19/h1-3,5-6,9-11,13H,4,7-8,12,14H2InChIKey
PSHNDCRPKTYXCZ-UHFFFAOYSA-NSynonyms
488794-45-2488794452
7((13benzodioxol5ylmethyl)sulfanyl)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
7((benzo(d)(13)dioxol5ylmethyl)thio)4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidine
C1CC2=C3C4=C(C(=NC=N4)SCC5=CC6=C(C=C5)OCO6)SC3=NC(=C2C1)C7=CC=CC=C7
InChI=1SC26H19N3O2S2c12516(631)221884717(18)212324(3325(21)2922)26(28132723)3212159101920(1115)31143019h135691113H4781214H2
MFCD03292691
ZINC000002591968
ZINC02591968
ZINC2591968
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