Vitas-M small molecule compound

8-(ethylsulfanyl)-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL005654
SMILES CCSc1nc2c(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 C20H20N4O2S MW 380.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O2S/c1-4-27-19-21-17-16(18(25)23(3)20(26)22(17)2)24(19)12-14-10-7-9-13-8-5-6-11-15(13)14/h5-11H,4,12H2,1-3H3
InChIKey
URJZGSNAIPCDIZ-UHFFFAOYSA-N
Synonyms
476480-83-8
476480838
8(ethylsulfanyl)13dimethyl7(naphthalen1ylmethyl)37dihydro1Hpurine26dione
8(ETHYLTHIO)13DIMETHYL7(NAPHTHALEN1YLMETHYL)1HPURINE26(3H7H)DIONE
8ETHYLSULFANYL13DIMETHYL7(NAPHTHALEN1YLMETHYL)PURINE26DIONE
8ETHYLTHIO13DIMETHYL7(NAPHTHYLMETHYL)137TRIHYDROPURINE26DIONE
CCSC1=NC2=C(N1CC3=CC=CC4=CC=CC=C43)C(=O)N(C(=O)N2C)C
InChI=1SC20H20N4O2Sc142719211716(18(25)23(3)20(26)22(17)2)24(19)12141079138561115(13)14h511H412H213H3
MFCD03933643
ZINC000000796306
ZINC00796306
ZINC796306

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Available files

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