9BV
Summary
| Name: | tetrazolo[5,1-b]quinazolin-9-ol |
| Formula: | C8 H5 N5 O |
| Formal charge: | 0 |
| Formula weight: | 187.158 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | tetrazolo[5,1-b]quinazolin-9-ol |
| OpenEye OEToolkits | 2.0.6 | [1,2,3,4]tetrazolo[5,1-b]quinazolin-9-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c21nc3nnnn3c(c1cccc2)O |
| InChI | InChI | 1.03 | InChI=1S/C8H5N5O/c14-7-5-3-1-2-4-6(5)9-8-10-11-12-13(7)8/h1-4,14H |
| InChIKey | InChI | 1.03 | MBODJNHSMUWROS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1n2nnnc2nc3ccccc13 |
| SMILES | CACTVS | 3.385 | Oc1n2nnnc2nc3ccccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)c(n3c(n2)nnn3)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)c(n3c(n2)nnn3)O |
