A1CDT
Summary
| Name: | N-(2-aminoethyl)thiophene-2-carboxamide |
| Formula: | C7 H10 N2 O S |
| Formal charge: | 0 |
| Formula weight: | 170.232 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | N-(2-aminoethyl)thiophene-2-carboxamide |
| OpenEye OEToolkits | 3.1.0.0 | ~{N}-(2-azanylethyl)thiophene-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(NCCN)c1cccs1 |
| InChI | InChI | 1.06 | InChI=1S/C7H10N2OS/c8-3-4-9-7(10)6-2-1-5-11-6/h1-2,5H,3-4,8H2,(H,9,10) |
| InChIKey | InChI | 1.06 | HKAFVQQLGBEDEZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCCNC(=O)c1sccc1 |
| SMILES | CACTVS | 3.385 | NCCNC(=O)c1sccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(sc1)C(=O)NCCN |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(sc1)C(=O)NCCN |
