1MC
Summary
| Name: | 1-METHYLCYTOSINE |
| Formula: | C5 H7 N3 O |
| Formal charge: | 0 |
| Formula weight: | 125.129 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-amino-1-methylpyrimidin-2(1H)-one |
| OpenEye OEToolkits | 1.5.0 | 4-amino-1-methyl-pyrimidin-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1N=C(N)C=CN1C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN1C=CC(=NC1=O)N |
| SMILES | CACTVS | 3.341 | CN1C=CC(=NC1=O)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN1C=CC(=NC1=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN1C=CC(=NC1=O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H7N3O/c1-8-3-2-4(6)7-5(8)9/h2-3H,1H3,(H2,6,7,9) |
| InChIKey | InChI | 1.03 | HWPZZUQOWRWFDB-UHFFFAOYSA-N |
