Vitas-M small molecule compound

N~3~-(2-chloro-7H-purin-6-yl)-N-[2-(1H-imidazol-4-yl)ethyl]-beta-alaninamide

Catalog ID
STK627456
SMILES O=C(CCNc1nc(Cl)nc2c1[nH]cn2)NCCc1c[nH]cn1

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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 C13H15ClN8O MW 334.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN8O/c14-13-21-11(10-12(22-13)20-7-19-10)17-4-2-9(23)16-3-1-8-5-15-6-18-8/h5-7H,1-4H2,(H,15,18)(H,16,23)(H2,17,19,20,21,22)
InChIKey
QEUVZZMVXPJLKZ-UHFFFAOYSA-N
Synonyms
929839-57-6
3((2chloro7Hpurin6yl)amino)N(2(1Himidazol5yl)ethyl)propanamide
929839576
C1=C(NC=N1)CCNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl
InChI=1SC13H15ClN8Oc14132111(1012(2213)2071910)17429(23)163185156188h57H14H2(H1518)(H1623)(H21719202122)
MFCD09794665
N(2(1Himidazol4yl)ethyl)3((2chloro9Hpurin6yl)amino)propanamide
N~3~(2chloro7Hpurin6yl)N(2(1Himidazol4yl)ethyl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N(2(1HIMIDAZOL4YL)ETHYL)BETAALANINAMIDE
O=C(CCNc1nc(Cl)nc2c1(nH)cn2)NCCc1c(nH)cn1
O=C(NCCc1nc(nH)c1)CCNc1nc(Cl)nc2c1nc(nH)2
ZINC000009420923
ZINC9420923

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Available files

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