ZEC
Summary
Name: | 6-HYDROXY-1,3-BENZOTHIAZOLE-2-SULFONAMIDE |
Formula: | C7 H6 N2 O3 S2 |
Formal charge: | 0 |
Formula weight: | 230.264 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 6-hydroxy-1,3-benzothiazole-2-sulfonamide |
OpenEye OEToolkits | 1.5.0 | 6-hydroxy-1,3-benzothiazole-2-sulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(c1nc2ccc(O)cc2s1)N |
SMILES_CANONICAL | CACTVS | 3.341 | N[S](=O)(=O)c1sc2cc(O)ccc2n1 |
SMILES | CACTVS | 3.341 | N[S](=O)(=O)c1sc2cc(O)ccc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1O)sc(n2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc2c(cc1O)sc(n2)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C7H6N2O3S2/c8-14(11,12)7-9-5-2-1-4(10)3-6(5)13-7/h1-3,10H,(H2,8,11,12) |
InChIKey | InChI | 1.03 | NOOBQTYVTDBXTL-UHFFFAOYSA-N |