NSV
Summary
| Name: | 1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine |
| Formula: | C9 H15 N3 S |
| Formal charge: | 0 |
| Formula weight: | 197.3 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine |
| OpenEye OEToolkits | 2.0.6 | 2-methyl-5-(piperazin-1-ylmethyl)-1,3-thiazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2cc(CN1CCNCC1)sc2C |
| InChI | InChI | 1.03 | InChI=1S/C9H15N3S/c1-8-11-6-9(13-8)7-12-4-2-10-3-5-12/h6,10H,2-5,7H2,1H3 |
| InChIKey | InChI | 1.03 | JBVOQOLBRWVANK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1sc(CN2CCNCC2)cn1 |
| SMILES | CACTVS | 3.385 | Cc1sc(CN2CCNCC2)cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1ncc(s1)CN2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1ncc(s1)CN2CCNCC2 |
