1LS
1-[4-(piperidin-1-ylsulfonyl)phenyl]-3-(pyridin-3-ylmethyl)thiourea
Find entries where: 1LS
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 1-[4-(piperidin-1-ylsulfonyl)phenyl]-3-(pyridin-3-ylmethyl)thiourea |
| Identifiers | 1-(4-piperidin-1-ylsulfonylphenyl)-3-(pyridin-3-ylmethyl)thiourea |
| Formula | C18 H22 N4 O2 S2 |
| Molecular Weight | 390.523 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(cnc1)CNC(=S)Nc2ccc(cc2)S(=O)(=O)N3CCCCC3 |
| InChI | InChI=1S/C18H22N4O2S2/c23-26(24,22-11-2-1-3-12-22)17-8-6-16(7-9-17)21-18(25)20-14-15-5-4-10-19-13-15/h4-10,13H,1-3,11-12,14H2,(H2,20,21,25) |
| InChIKey | NIADLWNDYLCGNO-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 48 |
| Chiral Atom Count | 0 |
| Bond Count | 50 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL1586371 |
| PubChem | 317146, 2803102 |
| ChEMBL | CHEMBL1586371 |
