Vitas-M small molecule compound
2-{[5-(piperidin-1-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]amino}propan-1-ol
Catalog ID
STL239951
SMILES OCC(Nc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCCCC1)C
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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 C21H27N5OS MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5OS/c1-13(11-27)24-19-18-17(22-12-23-19)16-14-7-3-4-8-15(14)20(25-21(16)28-18)26-9-5-2-6-10-26/h12-13,27H,2-11H2,1H3,(H,22,23,24)InChIKey
VKCUQHUMOZHZEM-UHFFFAOYSA-NSynonyms
844854-74-62((5(piperidin1yl)1234tetrahydropyrimido(4545)thieno(23c)isoquinolin8yl)amino)propan1ol
844854746
CC(CO)NC1=NC=NC2=C1SC3=NC(=C4CCCCC4=C23)N5CCCCC5
InChI=1SC21H27N5OSc113(1127)24191817(22122319)1614734815(14)20(2521(16)2818)2695261026h121327H211H21H3(H222324)
MFCD04164827
ZINC000020358493
ZINC000020358495
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