6KT
Summary
| Name: | 2-amino-1,3-benzothiazole-6-carboxamide |
| Formula: | C8 H7 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 193.226 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-amino-1,3-benzothiazole-6-carboxamide |
| OpenEye OEToolkits | 2.0.4 | 2-azanyl-1,3-benzothiazole-6-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2c1c(nc(N)s1)ccc2C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C8H7N3OS/c9-7(12)4-1-2-5-6(3-4)13-8(10)11-5/h1-3H,(H2,9,12)(H2,10,11) |
| InChIKey | InChI | 1.03 | HPRLVAQRFQEQPF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=O)c1ccc2nc(N)sc2c1 |
| SMILES | CACTVS | 3.385 | NC(=O)c1ccc2nc(N)sc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cc2c(cc1C(=O)N)sc(n2)N |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1cc2c(cc1C(=O)N)sc(n2)N |
