XG1
Summary
| Name: | 2-butyl-2H-pyrazolo[3,4-c]quinolin-4-amine |
| Formula: | C14 H16 N4 |
| Formal charge: | 0 |
| Formula weight: | 240.304 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-butyl-2H-pyrazolo[3,4-c]quinolin-4-amine |
| OpenEye OEToolkits | 1.7.6 | 2-butylpyrazolo[3,4-c]quinolin-4-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c3c(c1cn(nc1c2N)CCCC)cccc3 |
| InChI | InChI | 1.03 | InChI=1S/C14H16N4/c1-2-3-8-18-9-11-10-6-4-5-7-12(10)16-14(15)13(11)17-18/h4-7,9H,2-3,8H2,1H3,(H2,15,16) |
| InChIKey | InChI | 1.03 | BRUVQRFMAMBUDN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCn1cc2c3ccccc3nc(N)c2n1 |
| SMILES | CACTVS | 3.385 | CCCCn1cc2c3ccccc3nc(N)c2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCn1cc2c3ccccc3nc(c2n1)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCn1cc2c3ccccc3nc(c2n1)N |
