Vitas-M small molecule compound
2-{[3-methyl-2,6-dioxo-7-(3-phenylpropyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK834832
SMILES O=C(Nc1ccccc1)CSc1nc2c(n1CCCc1ccccc1)c(=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 C23H23N5O3S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O3S/c1-27-20-19(21(30)26-22(27)31)28(14-8-11-16-9-4-2-5-10-16)23(25-20)32-15-18(29)24-17-12-6-3-7-13-17/h2-7,9-10,12-13H,8,11,14-15H2,1H3,(H,24,29)(H,26,30,31)InChIKey
QMLWXZSDYFGNGF-UHFFFAOYSA-NSynonyms
326918-91-62((3methyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)sulfanyl)Nphenylacetamide
2((3methyl26dioxo7(3phenylpropyl)2367tetrahydro1Hpurin8yl)thio)Nphenylacetamide
2(3METHYL26DIOXO7(3PHENYLPROPYL)(137TRIHYDROPURIN8YLTHIO))NPHENYLACETAMIDE
2(3METHYL26DIOXO7(3PHENYLPROPYL)PURIN8YL)SULFANYLNPHENYLACETAMIDE
326918916
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3)CCCC4=CC=CC=C4
InChI=1SC23H23N5O3Sc1272019(21(30)2622(27)31)28(148111694251016)23(2520)321518(29)2417126371317h279101213H8111415H21H3(H2429)(H263031)
MFCD01032189
O=C(Nc1ccccc1)CSc1nc2c(n1CCCc1ccccc1)c(=O)(nH)c(=O)n2C
ZINC000000662964
ZINC00662964
ZINC662964
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