3Y1
2-amino-4-bromo-N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}benzamide
Find entries where: 3Y1
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 2-amino-4-bromo-N-{1-[(cyanomethyl)carbamoyl]cyclohexyl}benzamide |
| Identifiers | 2-azanyl-4-bromanyl-N-[1-(cyanomethylcarbamoyl)cyclohexyl]benzamide |
| Formula | C16 H19 Br N4 O2 |
| Molecular Weight | 379.252 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1cc(c(cc1Br)N)C(=O)NC2(CCCCC2)C(=O)NCC#N |
| InChI | InChI=1S/C16H19BrN4O2/c17-11-4-5-12(13(19)10-11)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 | KVQZUZVIKTWMTQ-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 | CHEMBL3605410 |
| PubChem | 91885636 |
| ChEMBL | CHEMBL3605410 |
