BGU
Summary
| Name: | 2,6-diamino-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one |
| Synonyms: | 2-Amino-lin-Benzogunaine |
| Formula: | C9 H8 N6 O |
| Formal charge: | 0 |
| Formula weight: | 216.199 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 2,6-diamino-1,7-dihydro-8H-imidazo[4,5-g]quinazolin-8-one |
| OpenEye OEToolkits | 1.5.0 | 2,6-diamino-1,7-dihydroimidazo[5,4-g]quinazolin-8-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1c3c(N=C(N1)N)cc2nc(N)nc2c3 |
| SMILES_CANONICAL | CACTVS | 3.341 | NC1=Nc2cc3nc(N)[nH]c3cc2C(=O)N1 |
| SMILES | CACTVS | 3.341 | NC1=Nc2cc3nc(N)[nH]c3cc2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c2c(cc3c1[nH]c(n3)N)N=C(NC2=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1c2c(cc3c1[nH]c(n3)N)N=C(NC2=O)N |
| InChI | InChI | 1.03 | InChI=1S/C9H8N6O/c10-8-13-5-1-3-4(2-6(5)14-8)12-9(11)15-7(3)16/h1-2H,(H3,10,13,14)(H3,11,12,15,16) |
| InChIKey | InChI | 1.03 | WFECBOHPSURSGU-UHFFFAOYSA-N |
