Vitas-M small molecule compound
ethyl [(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Catalog ID
STK839199
SMILES CCOC(=O)CSc1nc2c(n1Cc1ccccc1)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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-4-26-13(23)11-27-17-19-15-14(16(24)21(3)18(25)20(15)2)22(17)10-12-8-6-5-7-9-12/h5-9H,4,10-11H2,1-3H3InChIKey
WTWHNMAKNZONHB-UHFFFAOYSA-NSynonyms
372500-29-3372500293
CCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C
ethyl((7benzyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
ethyl2((7benzyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
ETHYL2(13DIMETHYL26DIOXO7BENZYL137TRIHYDROPURIN8YLTHIO)ACETATE
ETHYL2(7BENZYL13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETATE
InChI=1SC18H20N4O4Sc142613(23)112717191514(16(24)21(3)18(25)20(15)2)22(17)10128657912h59H41011H213H3
MFCD01943475
ZINC000000623502
ZINC00623502
ZINC623502
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