Vitas-M small molecule compound
2-[(3-methyl-7-octyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Catalog ID
STK528971
SMILES CCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C
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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 C16H25N5O3S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25N5O3S/c1-3-4-5-6-7-8-9-21-12-13(18-16(21)25-10-11(17)22)20(2)15(24)19-14(12)23/h3-10H2,1-2H3,(H2,17,22)(H,19,23,24)InChIKey
UPLOCPGDSRXFTB-UHFFFAOYSA-NSynonyms
301354-13-22((3methyl7octyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetamide
2((3methyl7octyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetamide
2(3METHYL7OCTYL26DIOXO137TRIHYDROPURIN8YLTHIO)ACETAMIDE
2(3METHYL7OCTYL26DIOXOPURIN8YL)SULFANYLACETAMIDE
301354132
CCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C
InChI=1SC16H25N5O3Sc13456789211213(1816(21)251011(17)22)20(2)15(24)1914(12)23h310H212H3(H21722)(H192324)
MFCD00612619
ZINC000097996157
ZINC97996157
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