J2T
Summary
| Name: | N-(2,3-dihydro-1H-inden-5-yl)tetrazolo[1,5-b]pyridazin-6-amine |
| Formula: | C13 H12 N6 |
| Formal charge: | 0 |
| Formula weight: | 252.275 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(2,3-dihydro-1H-inden-5-yl)tetrazolo[1,5-b]pyridazin-6-amine |
| OpenEye OEToolkits | 1.7.6 | N-(2,3-dihydro-1H-inden-5-yl)-[1,2,3,4]tetrazolo[1,5-b]pyridazin-6-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1c(ccc2nnnn12)Nc3cc4c(cc3)CCC4 |
| InChI | InChI | 1.03 | InChI=1S/C13H12N6/c1-2-9-4-5-11(8-10(9)3-1)14-12-6-7-13-15-17-18-19(13)16-12/h4-8H,1-3H2,(H,14,16) |
| InChIKey | InChI | 1.03 | XUXHXRTXDKMOCI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C1Cc2ccc(Nc3ccc4nnnn4n3)cc2C1 |
| SMILES | CACTVS | 3.370 | C1Cc2ccc(Nc3ccc4nnnn4n3)cc2C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Nc3ccc4nnnn4n3)CCC2 |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Nc3ccc4nnnn4n3)CCC2 |
