Vitas-M small molecule compound
3-{[2,2-dimethyl-5-(pyrrolidin-1-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]amino}propan-1-ol
Catalog ID
STK553902
SMILES OCCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCCC1
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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 C21H27N5O2S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O2S/c1-21(2)10-13-14(11-28-21)19(26-7-3-4-8-26)25-20-15(13)16-17(29-20)18(24-12-23-16)22-6-5-9-27/h12,27H,3-11H2,1-2H3,(H,22,23,24)InChIKey
NJHKTUWMBJSPDZ-UHFFFAOYSA-NSynonyms
840464-41-73((22dimethyl5(pyrrolidin1yl)14dihydro2Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)propan1ol
3((22dimethyl5(pyrrolidin1yl)24dihydro1Hpyrano(4345)pyrido(3245)thieno(32d)pyrimidin8yl)amino)propan1ol
840464417
CC1(CC2=C3C4=C(C(=NC=N4)NCCCO)SC3=NC(=C2CO1)N5CCCC5)C
InChI=1SC21H27N5O2Sc121(2)101314(112821)19(26734826)252015(13)1617(2920)18(24122316)2265927h1227H311H212H3(H222324)
MFCD04004911
ZINC000020029358
ZINC20029358
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