Vitas-M small molecule compound
2-{2-[(4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino]ethoxy}ethanol
Catalog ID
STL304057
SMILES OCCOCCNc1ncnc2c1sc1c2c2CCCc2c(n1)c1ccccc1
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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 C22H22N4O2S MW 406.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O2S/c27-10-12-28-11-9-23-21-20-19(24-13-25-21)17-15-7-4-8-16(15)18(26-22(17)29-20)14-5-2-1-3-6-14/h1-3,5-6,13,27H,4,7-12H2,(H,23,24,25)InChIKey
XABUFCZNSVOUKR-UHFFFAOYSA-NSynonyms
846585-77-12(2((4phenyl23dihydro1Hcyclopenta(45)pyrido(3245)thieno(32d)pyrimidin7yl)amino)ethoxy)ethanol
846585771
C1CC2=C3C4=C(C(=NC=N4)NCCOCCO)SC3=NC(=C2C1)C5=CC=CC=C5
InChI=1SC22H22N4O2Sc2710122811923212019(24132521)171574816(15)18(2622(17)2920)145213614h13561327H4712H2(H232425)
MFCD04177657
ZINC000002415946
ZINC02415946
ZINC2415946
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