Vitas-M small molecule compound
7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-8-[(4-methylbenzyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK019637
SMILES Cc1ccc(cc1)CSc1nc2c(n1CC(COc1cccc3c1cccc3)O)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 C27H26N4O4S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4S/c1-17-10-12-18(13-11-17)16-36-27-28-24-23(25(33)29-26(34)30(24)2)31(27)14-20(32)15-35-22-9-5-7-19-6-3-4-8-21(19)22/h3-13,20,32H,14-16H2,1-2H3,(H,29,33,34)InChIKey
OCKJPVIPBUZTDS-UHFFFAOYSA-NSynonyms
303970-41-4303970414
7(2HYDROXY3(NAPHTHALEN1YLOXY)PROPYL)3METHYL8((4METHYLBENZYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7(2hydroxy3(naphthalen1yloxy)propyl)3methyl8((4methylbenzyl)thio)1Hpurine26(3H7H)dione
7(2HYDROXY3NAPHTHALEN1YLOXYPROPYL)3METHYL8((4METHYLPHENYL)METHYLSULFANYL)PURINE26DIONE
7(2HYDROXY3NAPHTHYLOXYPROPYL)3METHYL8((4METHYLPHENYL)METHYLTHIO)137TRIHYDROPURINE26DIONE
CC1=CC=C(C=C1)CSC2=NC3=C(N2CC(COC4=CC=CC5=CC=CC=C54)O)C(=O)NC(=O)N3C
Cc1ccc(cc1)CSc1nc2c(n1CC(COc1cccc3c1cccc3)O)c(=O)(nH)c(=O)n2C
InChI=1SC27H26N4O4Sc117101218(131117)163627282423(25(33)2926(34)30(24)2)31(27)1420(32)15352295719634821(19)22h3132032H1416H212H3(H293334)
MFCD01555005
STK019637
ZINC000000850069
ZINC000000850070
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.