Vitas-M small molecule compound
methyl [(7-benzyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Catalog ID
STK838964
SMILES COC(=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 C17H18N4O4S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O4S/c1-19-14-13(15(23)20(2)17(19)24)21(9-11-7-5-4-6-8-11)16(18-14)26-10-12(22)25-3/h4-8H,9-10H2,1-3H3InChIKey
UEFOGWHVVZPWCY-UHFFFAOYSA-NSynonyms
373369-45-0373369450
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCC(=O)OC)CC3=CC=CC=C3
InChI=1SC17H18N4O4Sc1191413(15(23)20(2)17(19)24)21(9117546811)16(1814)261012(22)253h48H910H213H3
methyl((7benzyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetate
methyl2((7benzyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetate
METHYL2(13DIMETHYL26DIOXO7BENZYL137TRIHYDROPURIN8YLTHIO)ACETATE
METHYL2(7BENZYL13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETATE
MFCD01946620
ZINC000000624677
ZINC00624677
ZINC624677
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