VAB
4-oxo-4-{[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]amino}butanoic acid
Find entries where: VAB
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 4-oxo-4-{[2-(prop-2-en-1-ylsulfanyl)-1,3-benzothiazol-6-yl]amino}butanoic acid |
| Identifiers | 4-oxidanylidene-4-[(2-prop-2-enylsulfanyl-1,3-benzothiazol-6-yl)amino]butanoic acid |
| Formula | C14 H14 N2 O3 S2 |
| Molecular Weight | 322.403 |
| Type | NON-POLYMER |
| Isomeric SMILES | C=CCSc1nc2ccc(cc2s1)NC(=O)CCC(=O)O |
| InChI | InChI=1S/C14H14N2O3S2/c1-2-7-20-14-16-10-4-3-9(8-11(10)21-14)15-12(17)5-6-13(18)19/h2-4,8H,1,5-7H2,(H,15,17)(H,18,19) |
| InChIKey | MTRGAKUTJCSVKA-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 35 |
| Chiral Atom Count | 0 |
| Bond Count | 36 |
| Aromatic Bond Count | 10 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 331941 |
| ChEMBL | CHEMBL2059001 |
