HZT
Summary
| Name: | ~{N}-[(4-fluorophenyl)methyl]-~{N}-(1~{H}-1,2,4-triazol-5-ylmethyl)thiophene-2-sulfonamide |
| Formula: | C14 H13 F N4 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 352.407 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-[(4-fluorophenyl)methyl]-~{N}-(1~{H}-1,2,4-triazol-5-ylmethyl)thiophene-2-sulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H13FN4O2S2/c15-12-5-3-11(4-6-12)8-19(9-13-16-10-17-18-13)23(20,21)14-2-1-7-22-14/h1-7,10H,8-9H2,(H,16,17,18) |
| InChIKey | InChI | 1.03 | UGVZRLMKBSBNEC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(CN(Cc2[nH]ncn2)[S](=O)(=O)c3sccc3)cc1 |
| SMILES | CACTVS | 3.385 | Fc1ccc(CN(Cc2[nH]ncn2)[S](=O)(=O)c3sccc3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(sc1)S(=O)(=O)N(Cc2ccc(cc2)F)Cc3[nH]ncn3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(sc1)S(=O)(=O)N(Cc2ccc(cc2)F)Cc3[nH]ncn3 |
