Vitas-M small molecule compound
1-methyl-6,7,8,9-tetrahydro[1,3]thiazepino[2,3-f]purine-2,4(1H,3H)-dione
Catalog ID
STK529728
SMILES O=c1[nH]c(=O)n(c2c1n1CCCCSc1n2)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 C10H12N4O2S MW 252.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O2S/c1-13-7-6(8(15)12-9(13)16)14-4-2-3-5-17-10(14)11-7/h2-5H2,1H3,(H,12,15,16)InChIKey
SNHYIIVBRKLSTJ-UHFFFAOYSA-NSynonyms
178452-73-8178452738
1methyl6789tetrahydro(13)thiazepino(23f)purine24(1H3H)dione
1methyl6789tetrahydropurino(87b)(13)thiazepine24dione
CN1C2=C(C(=O)NC1=O)N3CCCCSC3=N2
InChI=1SC10H12N4O2Sc11376(8(15)129(13)16)1442351710(14)117h25H21H3(H121516)
MFCD00653082
O=c1(nH)c(=O)n(c2c1n1CCCCSc1n2)C
ZINC000000477994
ZINC00477994
ZINC477994
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