Vitas-M small molecule compound
2,2'-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]imino}diethanol
Catalog ID
STK836169
SMILES OCCN(c1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CCO
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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 C21H27N5O3S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3S/c27-9-5-25(6-10-28)20-18-17(22-13-23-20)16-14-3-1-2-4-15(14)19(24-21(16)30-18)26-7-11-29-12-8-26/h13,27-28H,1-12H2InChIKey
NTFIXEKMMYPNIY-UHFFFAOYSA-NSynonyms
22((5(morpholin4yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)imino)diethanol
22((5morpholino1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)azanediyl)diethanol
C1CCC2=C(N=C3C(=C2C1)C4=C(S3)C(=NC=N4)N(CCO)CCO)N5CCOCC5
InChI=1SC21H27N5O3Sc279525(61028)201817(22132320)1614312415(14)19(2421(16)3018)267112912826h132728H112H2
MFCD02236391
ZINC000019939990
ZINC19939990
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