Q7F
Summary
| Name: | 6-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-~{N}4-phenyl-1,3,5-triazine-2,4-diamine |
| Formula: | C17 H20 N6 S |
| Formal charge: | 0 |
| Formula weight: | 340.446 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 3.1.0.0 | 6-[[methyl-[(3-methylthiophen-2-yl)methyl]amino]methyl]-~{N}4-phenyl-1,3,5-triazine-2,4-diamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H20N6S/c1-12-8-9-24-14(12)10-23(2)11-15-20-16(18)22-17(21-15)19-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H3,18,19,20,21,22) |
| InChIKey | InChI | 1.06 | PJORKXLDJATLJK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN(Cc1sccc1C)Cc2nc(N)nc(Nc3ccccc3)n2 |
| SMILES | CACTVS | 3.385 | CN(Cc1sccc1C)Cc2nc(N)nc(Nc3ccccc3)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1ccsc1CN(C)Cc2nc(nc(n2)Nc3ccccc3)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1ccsc1CN(C)Cc2nc(nc(n2)Nc3ccccc3)N |
