Vitas-M small molecule compound
ethyl {[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetate
Catalog ID
STK743601
SMILES CCOC(=O)CSc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C
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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 C18H19FN4O4S MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19FN4O4S/c1-4-27-13(24)10-28-17-20-15-14(16(25)22(3)18(26)21(15)2)23(17)9-11-7-5-6-8-12(11)19/h5-8H,4,9-10H2,1-3H3InChIKey
MPIZQZMYDSMDTG-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3F)C(=O)N(C(=O)N2C)C
ethyl((7(2fluorobenzyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
ETHYL2(7((2FLUOROPHENYL)METHYL)13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETATE
InChI=1SC18H19FN4O4Sc142713(24)102817201514(16(25)22(3)18(26)21(15)2)23(17)911756812(11)19h58H4910H213H3
MFCD04060420
ZINC000001444396
ZINC01444396
ZINC1444396
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