6CC
Summary
Name: | 5-(2-amino-1,3-thiazol-4-yl)-2-chlorobenzene-1-sulfonamide |
Formula: | C9 H8 Cl N3 O2 S2 |
Formal charge: | 0 |
Formula weight: | 289.762 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 5-(2-amino-1,3-thiazol-4-yl)-2-chlorobenzene-1-sulfonamide |
OpenEye OEToolkits | 2.0.4 | 5-(2-azanyl-1,3-thiazol-4-yl)-2-chloranyl-benzenesulfonamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c2c(c1cc(c(Cl)cc1)S(=O)(=O)N)nc(N)s2 |
InChI | InChI | 1.03 | InChI=1S/C9H8ClN3O2S2/c10-6-2-1-5(3-8(6)17(12,14)15)7-4-16-9(11)13-7/h1-4H,(H2,11,13)(H2,12,14,15) |
InChIKey | InChI | 1.03 | YZFWRSMMUCDYLX-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1scc(n1)c2ccc(Cl)c(c2)[S](N)(=O)=O |
SMILES | CACTVS | 3.385 | Nc1scc(n1)c2ccc(Cl)c(c2)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1cc(c(cc1c2csc(n2)N)S(=O)(=O)N)Cl |
SMILES | OpenEye OEToolkits | 2.0.4 | c1cc(c(cc1c2csc(n2)N)S(=O)(=O)N)Cl |