CFK
Summary
| Name: | 3-(carbamoylamino)-5-phenylthiophene-2-carboxamide |
| Formula: | C12 H11 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 261.3 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-(carbamoylamino)-5-phenylthiophene-2-carboxamide |
| OpenEye OEToolkits | 1.7.0 | 3-(aminocarbonylamino)-5-phenyl-thiophene-2-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1sc(cc1NC(=O)N)c2ccccc2)N |
| SMILES_CANONICAL | CACTVS | 3.370 | NC(=O)Nc1cc(sc1C(N)=O)c2ccccc2 |
| SMILES | CACTVS | 3.370 | NC(=O)Nc1cc(sc1C(N)=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)c2cc(c(s2)C(=O)N)NC(=O)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccc(cc1)c2cc(c(s2)C(=O)N)NC(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C12H11N3O2S/c13-11(16)10-8(15-12(14)17)6-9(18-10)7-4-2-1-3-5-7/h1-6H,(H2,13,16)(H3,14,15,17) |
| InChIKey | InChI | 1.03 | HKWYRLYHYBFHLL-UHFFFAOYSA-N |
