I37
4-amino-N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}-3-fluorobenzamide
Find entries where: I37
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 4-amino-N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}-3-fluorobenzamide |
| Identifiers | 4-azanyl-N-[1-(cyanomethylcarbamoyl)cyclohexyl]-3-fluoranyl-benzamide |
| Formula | C16 H19 F N4 O2 |
| Molecular Weight | 318.346 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(c(cc1C(=O)NC2(CCCCC2)C(=O)NCC#N)F)N |
| InChI | InChI=1S/C16H19FN4O2/c17-12-10-11(4-5-13(12)19)14(22)21-16(6-2-1-3-7-16)15(23)20-9-8-18/h4-5,10H,1-3,6-7,9,19H2,(H,20,23)(H,21,22) |
| InChIKey | NEJGUCSKQVFSJQ-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 42 |
| Chiral Atom Count | 0 |
| Bond Count | 43 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL3605413 |
| PubChem | 91885514 |
| ChEMBL | CHEMBL3605413 |
