Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-N~3~-9H-purin-6-yl-beta-alaninamide
Catalog ID
STL287759
SMILES COc1cc(CCNC(=O)CCNc2ncnc3c2nc[nH]3)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 C18H22N6O3 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O3/c1-26-13-4-3-12(9-14(13)27-2)5-7-19-15(25)6-8-20-17-16-18(22-10-21-16)24-11-23-17/h3-4,9-11H,5-8H2,1-2H3,(H,19,25)(H2,20,21,22,23,24)InChIKey
PXDDEOXSWDUQEU-UHFFFAOYSA-NSynonyms
1010893-52-31010893523
3((9Hpurin6yl)amino)N(34dimethoxyphenethyl)propanamide
COC1=C(C=C(C=C1)CCNC(=O)CCNC2=NC=NC3=C2NC=N3)OC
COc1cc(CCNC(=O)CCNc2ncnc3c2nc(nH)3)ccc1OC
InChI=1SC18H22N6O3c126134312(914(13)272)571915(25)6820171618(22102116)24112317h34911H58H212H3(H1925)(H22021222324)
MFCD12029185
N(2(34dimethoxyphenyl)ethyl)3(7Hpurin6ylamino)propanamide
N(2(34dimethoxyphenyl)ethyl)N~3~9Hpurin6ylbetaalaninamide
N(2(34DIMETHOXYPHENYL)ETHYL)N39HPURIN6YLBETAALANINAMIDE
ZINC000012296870
ZINC12296870
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