Vitas-M small molecule compound
3-{8-[(4-ethoxyphenyl)amino]-6-hydroxy-3-methyl-2-oxo-2,3-dihydro-7H-purin-7-yl}propanenitrile
Catalog ID
STK635627
SMILES CCOc1ccc(cc1)Nc1nc2c(n1CCC#N)c(O)nc(=O)n2C
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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 C17H18N6O3 MW 354.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6O3/c1-3-26-12-7-5-11(6-8-12)19-16-20-14-13(23(16)10-4-9-18)15(24)21-17(25)22(14)2/h5-8H,3-4,10H2,1-2H3,(H,19,20)(H,21,24,25)InChIKey
ANOBGCVSMGHYRR-UHFFFAOYSA-NSynonyms
121511-68-0121511680
3(8((4ethoxyphenyl)amino)6hydroxy3methyl2oxo23dihydro7Hpurin7yl)propanenitrile
3(8(4ETHOXYANILINO)3METHYL26DIOXOPURIN7YL)PROPANENITRILE
CCOC1=CC=C(C=C1)NC2=NC3=C(N2CCC#N)C(=O)NC(=O)N3C
InChI=1SC17H18N6O3c1326127511(6812)1916201413(23(16)104918)15(24)2117(25)22(14)2h58H3410H212H3(H1920)(H212425)
MFCD18160794
ZINC000013511296
ZINC13511296
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