UX7
Summary
| Name: | N-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide |
| Formula: | C12 H12 N2 O2 S |
| Formal charge: | 0 |
| Formula weight: | 248.301 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | N-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(6-methoxy-1,3-benzothiazol-2-yl)cyclopropanecarboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N(C(=O)C1CC1)c2sc3c(n2)ccc(OC)c3 |
| InChI | InChI | 1.03 | InChI=1S/C12H12N2O2S/c1-16-8-4-5-9-10(6-8)17-12(13-9)14-11(15)7-2-3-7/h4-7H,2-3H2,1H3,(H,13,14,15) |
| InChIKey | InChI | 1.03 | TYZQOTDNVBPGAW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2nc(NC(=O)C3CC3)sc2c1 |
| SMILES | CACTVS | 3.385 | COc1ccc2nc(NC(=O)C3CC3)sc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)sc(n2)NC(=O)C3CC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)sc(n2)NC(=O)C3CC3 |
