Vitas-M small molecule compound
3-({6-amino-9-[2-(4-methylphenoxy)ethyl]-9H-purin-8-yl}sulfanyl)propanoic acid
Catalog ID
STK678347
SMILES OC(=O)CCSc1nc2c(n1CCOc1ccc(cc1)C)ncnc2N
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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 C17H19N5O3S MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3S/c1-11-2-4-12(5-3-11)25-8-7-22-16-14(15(18)19-10-20-16)21-17(22)26-9-6-13(23)24/h2-5,10H,6-9H2,1H3,(H,23,24)(H2,18,19,20)InChIKey
SPAGSAAVQRXJAE-UHFFFAOYSA-NSynonyms
3((6amino9(2(4methylphenoxy)ethyl)9Hpurin8yl)sulfanyl)propanoicacid
3(6AMINO9(2(4METHYLPHENOXY)ETHYL)PURIN8YL)SULFANYLPROPANOICACID
3(6AMINO9(2(4METHYLPHENOXY)ETHYL)PURIN8YLTHIO)PROPANOICACID
CC1=CC=C(C=C1)OCCN2C3=C(C(=NC=N3)N)N=C2SCCC(=O)O
InChI=1SC17H19N5O3Sc1112412(5311)2587221614(15(18)19102016)2117(22)269613(23)24h2510H69H21H3(H2324)(H2181920)
MFCD03034579
ZINC000001070365
ZINC1070365
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