O0J
Summary
Name: | N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]acetamide |
Formula: | C11 H11 N3 O S |
Formal charge: | 0 |
Formula weight: | 233.29 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]acetamide |
OpenEye OEToolkits | 2.0.6 | ~{N}-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Nc2nc(c1ccc(cc1)NC(C)=O)cs2 |
InChI | InChI | 1.03 | InChI=1S/C11H11N3OS/c1-7(15)13-9-4-2-8(3-5-9)10-6-16-11(12)14-10/h2-6H,1H3,(H2,12,14)(H,13,15) |
InChIKey | InChI | 1.03 | VBBNSESFUHRMJU-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)c2csc(N)n2 |
SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)c2csc(N)n2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)c2csc(n2)N |
SMILES | OpenEye OEToolkits | 2.0.6 | CC(=O)Nc1ccc(cc1)c2csc(n2)N |