Vitas-M small molecule compound
N~3~-(2-chloro-7H-purin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-beta-alaninamide
Catalog ID
STK631298
SMILES COc1cc(CCNC(=O)CCNc2nc(Cl)nc3c2[nH]cn3)ccc1OC
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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 C18H21ClN6O3 MW 404.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN6O3/c1-27-12-4-3-11(9-13(12)28-2)5-7-20-14(26)6-8-21-16-15-17(23-10-22-15)25-18(19)24-16/h3-4,9-10H,5-8H2,1-2H3,(H,20,26)(H2,21,22,23,24,25)InChIKey
RTWQEGDDVODQKY-UHFFFAOYSA-NSynonyms
929968-36-53((2chloro7Hpurin6yl)amino)N(2(34dimethoxyphenyl)ethyl)propanamide
3((2chloro9Hpurin6yl)amino)N(34dimethoxyphenethyl)propanamide
929968365
COC1=C(C=C(C=C1)CCNC(=O)CCNC2=NC(=NC3=C2NC=N3)Cl)OC
COc1cc(CCNC(=O)CCNc2nc(Cl)nc3c2(nH)cn3)ccc1OC
COc1cc(CCNC(=O)CCNc2nc(Cl)nc3c2nc(nH)3)ccc1OC
InChI=1SC18H21ClN6O3c127124311(913(12)282)572014(26)6821161517(23102215)2518(19)2416h34910H58H212H3(H2026)(H22122232425)
MFCD09793501
N~3~(2chloro7Hpurin6yl)N(2(34dimethoxyphenyl)ethyl)betaalaninamide
N3(2CHLORO7HPURIN6YL)N(2(34DIMETHOXYPHENYL)ETHYL)BETAALANINAMIDE
ZINC000009049032
ZINC09049032
ZINC9049032
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