Vitas-M small molecule compound
benzyl {[3-methyl-2,6-dioxo-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetate
Catalog ID
STK840185
SMILES O=C(CSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C)OCc1ccccc1
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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 C24H24N4O4S MW 464.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O4S/c1-27-21-20(22(30)26-23(27)31)28(14-8-13-17-9-4-2-5-10-17)24(25-21)33-16-19(29)32-15-18-11-6-3-7-12-18/h2-7,9-12H,8,13-16H2,1H3,(H,26,30,31)InChIKey
JPIQWCVHYRZEMW-UHFFFAOYSA-NSynonyms
377064-60-3377064603
benzyl((3methyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)sulfanyl)acetate
benzyl2((3methyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)thio)acetate
BENZYL2(3METHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)SULFANYLACETATE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)OCC3=CC=CC=C3)CCCC4=CC=CC=C4
InChI=1SC24H24N4O4Sc1272120(22(30)2623(27)31)28(148131794251017)24(2521)331619(29)321518116371218h27912H81316H21H3(H263031)
MFCD02736209
O=C(CSc1nc2c(n1CCCc1ccccc1)c(=O)(nH)c(=O)n2C)OCc1ccccc1
PHENYLMETHYL2(3METHYL26DIOXO7(3PHENYLPROPYL)137TRIHYDROPURIN8YLTHIO)ACETATE
ZINC000000629310
ZINC00629310
ZINC629310
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