K0A
Summary
| Name: | (2,5-dimethyl-1,3-thiazol-4-yl)(pyrrolidin-1-yl)methanone |
| Formula: | C10 H14 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 210.296 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2,5-dimethyl-1,3-thiazol-4-yl)(pyrrolidin-1-yl)methanone |
| OpenEye OEToolkits | 2.0.6 | (2,5-dimethyl-1,3-thiazol-4-yl)-pyrrolidin-1-yl-methanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N1(CCCC1)C(=O)c2c(sc(n2)C)C |
| InChI | InChI | 1.03 | InChI=1S/C10H14N2OS/c1-7-9(11-8(2)14-7)10(13)12-5-3-4-6-12/h3-6H2,1-2H3 |
| InChIKey | InChI | 1.03 | BRAPKXFMPGACJU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1sc(C)c(n1)C(=O)N2CCCC2 |
| SMILES | CACTVS | 3.385 | Cc1sc(C)c(n1)C(=O)N2CCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1c(nc(s1)C)C(=O)N2CCCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1c(nc(s1)C)C(=O)N2CCCC2 |
