| SpectraBase Spectrum ID |
5ZeyLDkPj0B |
| Name |
Acetic acid, 2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-, ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H22N4O4S |
| InChI |
InChI=1S/C19H22N4O4S/c1-5-27-14(24)11-28-18-20-16-15(17(25)22(4)19(26)21(16)3)23(18)10-13-9-7-6-8-12(13)2/h6-9H,5,10-11H2,1-4H3 |
| InChIKey |
BHQDGRGKGVOFLQ-UHFFFAOYSA-N |
| Molecular Weight |
402.469 g/mol |
| SMILES |
Cc1c(cccc1)C[n]1c(nc2N(C(=O)N(C(c12)=O)C)C)SCC(=O)OCC |
| SPLASH |
splash10-0a4i-3900000000-f9c3e1b101f4942118ff |
| Source of Spectrum |
IY-1-4692-3 |
| Synonyms |
2-[[1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-dioxo-8-purinyl]thio]acetic acid ethyl ester
Ethyl 2-[1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-dioxopurin-8-yl]sulfanylacetate
Ethyl 2-[1,3-dimethyl-7-(o-tolylmethyl)-2,6-dioxo-purin-8-yl]sulfanylacetate
Ethyl 2-[1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanoate |
| Wiley ID |
1654906 |
![Acetic acid, 2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-, ethyl ester](/api/spectrum/5ZeyLDkPj0B/structure.png?h=300&w=458 "Acetic acid, 2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(2-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-, ethyl ester")
