Vitas-M small molecule compound
2-{[7-(3-chlorobenzyl)-6-hydroxy-3-methyl-2-oxo-3,7-dihydro-2H-purin-8-yl]sulfanyl}-N-phenylacetamide
Catalog ID
STK559224
SMILES O=C(Nc1ccccc1)CSc1nc2c(n1Cc1cccc(c1)Cl)c(O)nc(=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 C21H18ClN5O3S MW 455.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O3S/c1-26-18-17(19(29)25-20(26)30)27(11-13-6-5-7-14(22)10-13)21(24-18)31-12-16(28)23-15-8-3-2-4-9-15/h2-10H,11-12H2,1H3,(H,23,28)(H,25,29,30)InChIKey
ZNYKPJPMTMBGTP-UHFFFAOYSA-NSynonyms
124192-79-62((7(3chlorobenzyl)6hydroxy3methyl2oxo37dihydro2Hpurin8yl)sulfanyl)Nphenylacetamide
2(7((3CHLOROPHENYL)METHYL)3METHYL26DIOXOPURIN8YL)SULFANYLNPHENYLACETAMIDE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3)CC4=CC(=CC=C4)Cl
InChI=1SC21H18ClN5O3Sc1261817(19(29)2520(26)30)27(111365714(22)1013)21(2418)311216(28)23158324915h210H1112H21H3(H2328)(H252930)
MFCD03796163
ZINC000002908717
ZINC02908717
ZINC2908717
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