3KN
Summary
| Name: | 3-(5-amino-1,3,4-thiadiazol-2-yl)pyridin-4-amine |
| Formula: | C7 H7 N5 S |
| Formal charge: | 0 |
| Formula weight: | 193.229 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(5-amino-1,3,4-thiadiazol-2-yl)pyridin-4-amine |
| OpenEye OEToolkits | 1.9.2 | 5-(4-azanylpyridin-3-yl)-1,3,4-thiadiazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2cc(c1nnc(s1)N)c(N)cc2 |
| InChI | InChI | 1.03 | InChI=1S/C7H7N5S/c8-5-1-2-10-3-4(5)6-11-12-7(9)13-6/h1-3H,(H2,8,10)(H2,9,12) |
| InChIKey | InChI | 1.03 | MNHIQWZHQXNGMA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1sc(nn1)c2cnccc2N |
| SMILES | CACTVS | 3.385 | Nc1sc(nn1)c2cnccc2N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cncc(c1N)c2nnc(s2)N |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cncc(c1N)c2nnc(s2)N |
