Vitas-M small molecule compound

8-[(2-hydroxyethyl)sulfanyl]-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL340937
SMILES OCCSc1nc2c(n1Cc1cccc3c1cccc3)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 C20H20N4O3S MW 396.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3S/c1-22-17-16(18(26)23(2)20(22)27)24(19(21-17)28-11-10-25)12-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,25H,10-12H2,1-2H3
InChIKey
ZNGZNVUCMKXHMA-UHFFFAOYSA-N
Synonyms
476480-42-9
476480429
8((2hydroxyethyl)sulfanyl)13dimethyl7(naphthalen1ylmethyl)37dihydro1Hpurine26dione
8((2HYDROXYETHYL)THIO)13DIMETHYL7(NAPHTHALEN1YLMETHYL)1HPURINE26(3H7H)DIONE
8(2HYDROXYETHYLSULFANYL)13DIMETHYL7(NAPHTHALEN1YLMETHYL)PURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCO)CC3=CC=CC4=CC=CC=C43
InChI=1SC20H20N4O3Sc1221716(18(26)23(2)20(22)27)24(19(2117)28111025)121485713634915(13)14h3925H1012H212H3
MFCD03933591
ZINC000002368995
ZINC02368995
ZINC2368995

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Available files

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