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| Duplicate ID | |
|---|---|
| Molecule Name | N-isopentyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine |
| 10,10-dimethyl-N-(3-methylbutyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-amine | |
| Smiles | CC(CCNc1nc2sc3c(c2c2n1ncn2)CC(OC3)(C)C)C |
| InchiKey | JAWPXTSOZMHYCL-UHFFFAOYSA-N |
| InChi | InChI=1S/C17H23N5OS/c1-10(2)5-6-18-16-21-15-13(14-19-9-20-22(14)16)11-7-17(3,4)23-8-12(11)24-15/h9-10H,5-8H2,1-4H3,(H,18,21) |
| Formula | C17H23N5OS |
| Molecular weight | 345.462 |
| Rings | 4 |
| logP | 3.7213 |
| PSA | 92.58 |
| MR | 98.0607 |