Vitas-M small molecule compound
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-N~3~-9H-purin-6-yl-beta-alaninamide
Catalog ID
STL287843
SMILES O=C(CCNc1ncnc2c1nc[nH]2)NCCc1c[nH]c2c1cc(F)cc2
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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 C18H18FN7O MW 367.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18FN7O/c19-12-1-2-14-13(7-12)11(8-22-14)3-5-20-15(27)4-6-21-17-16-18(24-9-23-16)26-10-25-17/h1-2,7-10,22H,3-6H2,(H,20,27)(H2,21,23,24,25,26)InChIKey
UCDVACVFNFMBPR-UHFFFAOYSA-NSynonyms
1010929-11-91010929119
3((9Hpurin6yl)amino)N(2(5fluoro1Hindol3yl)ethyl)propanamide
C1=CC2=C(C=C1F)C(=CN2)CCNC(=O)CCNC3=NC=NC4=C3NC=N4
InChI=1SC18H18FN7Oc1912121413(712)11(82214)352015(27)4621171618(2492316)26102517h1271022H36H2(H2027)(H22123242526)
MFCD12029367
N(2(5fluoro1Hindol3yl)ethyl)3(7Hpurin6ylamino)propanamide
N(2(5fluoro1Hindol3yl)ethyl)N~3~9Hpurin6ylbetaalaninamide
N(2(5FLUORO1HINDOL3YL)ETHYL)N39HPURIN6YLBETAALANINAMIDE
O=C(CCNc1ncnc2c1nc(nH)2)NCCc1c(nH)c2c1cc(F)cc2
ZINC000012297113
ZINC12297113
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