| SpectraBase Spectrum ID |
B2sli4uD0KG |
| Name |
4-[[[7-(2-fluorobenzyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]thio]methyl]benzoic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H21FN4O4S |
| InChI |
InChI=1S/C23H21FN4O4S/c1-26-19-18(20(29)27(2)23(26)31)28(12-16-6-4-5-7-17(16)24)22(25-19)33-13-14-8-10-15(11-9-14)21(30)32-3/h4-11H,12-13H2,1-3H3 |
| InChIKey |
XCLRBHJNLVMHHR-UHFFFAOYSA-N |
| Molecular Weight |
468.503 g/mol |
| SMILES |
C1(=O)N(c2nc([n](c2C(=O)N1C)Cc1c(cccc1)F)SCc1ccc(cc1)C(OC)=O)C |
| SPLASH |
splash10-0aos-4901100000-8c7d615a0373a4498820 |
| Synonyms |
4-[[[7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-8-purinyl]thio]methyl]benzoic acid methyl ester
Methyl 4-({[7-(2-fluorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}methyl)benzoate
Methyl 4-[[7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylmethyl]benzoate
Methyl 4-[[7-[(2-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-purin-8-yl]sulfanylmethyl]benzoate |
| Wiley ID |
1445671 |
![4-[[[7-(2-fluorobenzyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]thio]methyl]benzoic acid methyl ester](/api/spectrum/B2sli4uD0KG/structure.png?h=300&w=458 "4-[[[7-(2-fluorobenzyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]thio]methyl]benzoic acid methyl ester")
