Vitas-M small molecule compound
2-{[3-methyl-2,6-dioxo-7-(prop-2-en-1-yl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK834898
SMILES C=CCn1c(SCC(=O)Nc2ccccc2)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 C17H17N5O3S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3S/c1-3-9-22-13-14(21(2)16(25)20-15(13)24)19-17(22)26-10-12(23)18-11-7-5-4-6-8-11/h3-8H,1,9-10H2,2H3,(H,18,23)(H,20,24,25)InChIKey
KWCARZHMNYBPOZ-UHFFFAOYSA-NSynonyms
330990-69-72((3methyl26dioxo7(prop2en1yl)2367tetrahydro1Hpurin8yl)sulfanyl)Nphenylacetamide
2((7allyl3methyl26dioxo2367tetrahydro1Hpurin8yl)thio)Nphenylacetamide
2(3METHYL26DIOXO7PROP2ENYLPURIN8YL)SULFANYLNPHENYLACETAMIDE
330990697
C=CCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3)CC=C
InChI=1SC17H17N5O3Sc139221314(21(2)16(25)2015(13)24)1917(22)261012(23)18117546811h38H1910H22H3(H1823)(H202425)
MFCD00658399
ZINC000000797351
ZINC00797351
ZINC797351
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