Vitas-M small molecule compound
2-{[1,3-dimethyl-7-(3-methylbenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK840358
SMILES O=C(Nc1ccccc1)CSc1nc2c(n1Cc1cccc(c1)C)c(=O)n(c(=O)n2C)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 C23H23N5O3S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O3S/c1-15-8-7-9-16(12-15)13-28-19-20(26(2)23(31)27(3)21(19)30)25-22(28)32-14-18(29)24-17-10-5-4-6-11-17/h4-12H,13-14H2,1-3H3,(H,24,29)InChIKey
JTYSFJIZVRSLFH-UHFFFAOYSA-NSynonyms
377056-81-02((13dimethyl7(3methylbenzyl)26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)Nphenylacetamide
2((13dimethyl7(3methylbenzyl)26dioxo2367tetrahydro1Hpurin8yl)thio)Nphenylacetamide
2(13DIMETHYL7((3METHYLPHENYL)METHYL)26DIOXO(137TRIHYDROPURIN8YLTHIO))NPHENYLACETAMIDE
2(13DIMETHYL7((3METHYLPHENYL)METHYL)26DIOXOPURIN8YL)SULFANYLNPHENYLACETAMIDE
377056810
CC1=CC(=CC=C1)CN2C3=C(N=C2SCC(=O)NC4=CC=CC=C4)N(C(=O)N(C3=O)C)C
InChI=1SC23H23N5O3Sc11587916(1215)13281920(26(2)23(31)27(3)21(19)30)2522(28)321418(29)2417105461117h412H1314H213H3(H2429)
MFCD02737558
ZINC000000637541
ZINC00637541
ZINC637541
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