KD8
Summary
| Name: | 6,7-dimethyl-2-sulfanylidene-1~{H}-pteridin-4-one |
| Formula: | C8 H8 N4 O S |
| Formal charge: | 0 |
| Formula weight: | 208.24 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6,7-dimethyl-2-sulfanylidene-1~{H}-pteridin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C8H8N4OS/c1-3-4(2)10-6-5(9-3)7(13)12-8(14)11-6/h1-2H3,(H2,10,11,12,13,14) |
| InChIKey | InChI | 1.03 | FMPVXDGAZOSEMT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc2NC(=S)NC(=O)c2nc1C |
| SMILES | CACTVS | 3.385 | Cc1nc2NC(=S)NC(=O)c2nc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(nc2c(n1)C(=O)NC(=S)N2)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(nc2c(n1)C(=O)NC(=S)N2)C |
