QGQ
Summary
| Name: | 3,5-dimethyl-4-[(6-methylpyrimidin-4-yl)sulfanylmethyl]-1,2-oxazole |
| Formula: | C11 H13 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 235.305 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3,5-dimethyl-4-[(6-methylpyrimidin-4-yl)sulfanylmethyl]-1,2-oxazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H13N3OS/c1-7-4-11(13-6-12-7)16-5-10-8(2)14-15-9(10)3/h4,6H,5H2,1-3H3 |
| InChIKey | InChI | 1.03 | ROKHJFVYDKKVDA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1onc(C)c1CSc2cc(C)ncn2 |
| SMILES | CACTVS | 3.385 | Cc1onc(C)c1CSc2cc(C)ncn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1cc(ncn1)SCc2c(noc2C)C |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ncn1)SCc2c(noc2C)C |
