Vitas-M small molecule compound
N~3~-(2-chloro-7H-purin-6-yl)-N-(1-phenylethyl)-beta-alaninamide
Catalog ID
STK618002
SMILES O=C(NC(c1ccccc1)C)CCNc1nc(Cl)nc2c1[nH]cn2
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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 C16H17ClN6O MW 344.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN6O/c1-10(11-5-3-2-4-6-11)21-12(24)7-8-18-14-13-15(20-9-19-13)23-16(17)22-14/h2-6,9-10H,7-8H2,1H3,(H,21,24)(H2,18,19,20,22,23)InChIKey
XMRKJEIJDXPNOC-UHFFFAOYSA-NSynonyms
(S)3((2chloro9Hpurin6yl)amino)N(1phenylethyl)propanamide
3((2chloro7Hpurin6yl)amino)N(1phenylethyl)propanamide
CC(C1=CC=CC=C1)NC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl
InChI=1SC16H17ClN6Oc110(115324611)2112(24)7818141315(2091913)2316(17)2214h26910H78H21H3(H2124)(H21819202223)
MFCD09790780
N~3~(2chloro7Hpurin6yl)N(1phenylethyl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N(1PHENYLETHYL)BETAALANINAMIDE
O=C(N(C@H)(c1ccccc1)C)CCNc1nc(Cl)nc2c1nc(nH)2
O=C(NC(c1ccccc1)C)CCNc1nc(Cl)nc2c1(nH)cn2
ZINC000009530911
ZINC000013552495
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