TG9
Summary
| Name: | 5-(cyclohexylamino)-4-phenyl-thiophene-2-carboximidamide |
| Formula: | C17 H21 N3 S |
| Formal charge: | 0 |
| Formula weight: | 299.434 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-(cyclohexylamino)-4-phenyl-thiophene-2-carboximidamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H21N3S/c18-16(19)15-11-14(12-7-3-1-4-8-12)17(21-15)20-13-9-5-2-6-10-13/h1,3-4,7-8,11,13,20H,2,5-6,9-10H2,(H3,18,19) |
| InChIKey | InChI | 1.06 | LKLBQIAVDGFJNW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=N)c1sc(NC2CCCCC2)c(c1)c3ccccc3 |
| SMILES | CACTVS | 3.385 | NC(=N)c1sc(NC2CCCCC2)c(c1)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [H]/N=C(/c1cc(c(s1)NC2CCCCC2)c3ccccc3)\N |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)c2cc(sc2NC3CCCCC3)C(=N)N |
