FDR
Summary
| Name: | 2-methyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
| Formula: | C10 H10 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 206.264 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-methyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1c2c3c(sc2N=C(N1)C)CCC3 |
| InChI | InChI | 1.03 | InChI=1S/C10H10N2OS/c1-5-11-9(13)8-6-3-2-4-7(6)14-10(8)12-5/h2-4H2,1H3,(H,11,12,13) |
| InChIKey | InChI | 1.03 | SSAMSKJKRMKXFV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CC1=Nc2sc3CCCc3c2C(=O)N1 |
| SMILES | CACTVS | 3.370 | CC1=Nc2sc3CCCc3c2C(=O)N1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | CC1=Nc2c(c3c(s2)CCC3)C(=O)N1 |
| SMILES | OpenEye OEToolkits | 1.7.2 | CC1=Nc2c(c3c(s2)CCC3)C(=O)N1 |
