A1C4R
Summary
| Name: | N-(2,6-dimethylphenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine |
| Formula: | C12 H16 N2 S |
| Formal charge: | 0 |
| Formula weight: | 220.334 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-(2,6-dimethylphenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-(2,6-dimethylphenyl)-5,6-dihydro-4~{H}-1,3-thiazin-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Cc1cccc(C)c1NC1=NCCCS1 |
| InChI | InChI | 1.06 | InChI=1S/C12H16N2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-15-12/h3,5-6H,4,7-8H2,1-2H3,(H,13,14) |
| InChIKey | InChI | 1.06 | BPICBUSOMSTKRF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1cccc(C)c1NC2=NCCCS2 |
| SMILES | CACTVS | 3.385 | Cc1cccc(C)c1NC2=NCCCS2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(c1NC2=NCCCS2)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1cccc(c1NC2=NCCCS2)C |
