UI2
Summary
| Name: | 8-(PYRIMIDIN-2-YLAMINO)NAPHTHALENE-2-CARBOXIMIDAMIDE |
| Formula: | C15 H13 N5 |
| Formal charge: | 0 |
| Formula weight: | 263.297 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 8-(pyrimidin-2-ylamino)naphthalene-2-carboximidamide |
| OpenEye OEToolkits | 1.5.0 | 8-(pyrimidin-2-ylamino)naphthalene-2-carboximidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n1cccnc1Nc2cccc3c2cc(C(=[N@H])N)cc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=N)c1ccc2cccc(Nc3ncccn3)c2c1 |
| SMILES | CACTVS | 3.341 | NC(=N)c1ccc2cccc(Nc3ncccn3)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2ccc(cc2c(c1)Nc3ncccn3)C(=N)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2ccc(cc2c(c1)Nc3ncccn3)C(=N)N |
| InChI | InChI | 1.03 | InChI=1S/C15H13N5/c16-14(17)11-6-5-10-3-1-4-13(12(10)9-11)20-15-18-7-2-8-19-15/h1-9H,(H3,16,17)(H,18,19,20) |
| InChIKey | InChI | 1.03 | GRQLDCHTDNYVQI-UHFFFAOYSA-N |
