| Code/trivial name | IUPAC name/SMILES notation/InChiKeya | Structural formulab |
|---|---|---|
| Profoxydim (BAS 625H) |
(5RS)‐2‐{(1EZ)‐N‐[(2RS)‐2‐(4‐chlorophenoxy)propoxy]butanimidoyl}‐3‐hydroxy‐5‐[(3RS)‐thian‐3‐yl]cyclohex‐2‐en‐1‐one Clc1ccc(cc1)OC(C)CO\N=C(/CCC)C=2C(=O)CC(CC=2O)C3CCCSC3 KRQUFUKTQHISJB‐UHFFFAOYSA‐N |
|
| BAS 625‐Li |
lithium (5RS)‐2‐{(1EZ)‐N‐[(2RS)‐2‐(4‐chlorophenoxy)propoxy]butanimidoyl}‐3‐oxo‐5‐[(3RS)‐thian‐3‐yl]cyclohex‐1‐en‐1‐olate [Li+].Clc1ccc(cc1)OC(C)CO\N=C(/CCC)C=2C(=O)CC(CC=2[O‐])C3CCCSC3 LRGTYGSKTGIXOL‐UHFFFAOYSA‐M |
|
| BH 625‐1 and isomer |
(3RS)‐3‐[(1RS)‐4‐{(1EZ)‐N‐[(2RS)‐2‐(4‐chlorophenoxy)propoxy]butanimidoyl}‐3‐hydroxy‐5‐oxocyclohex‐3‐en‐1‐yl]‐1λ4‐thian‐1‐one O=S1CCCC(C1)C3CC(=O)C(C(\CCC)=N\OCC(C)Oc2ccc(Cl)cc2)=C(O)C3 AJYSITMZKMUSQF‐UHFFFAOYSA‐N |
|
| BH 625‐27 = 625M27 carboxylic acid derivative |
3‐[(3RS)‐1‐oxo‐1λ4‐thian‐3‐yl]pentanedioic acid O=S1CCCC(C1)C(CC(=O)O)CC(=O)O DVZHDNBXUJHHIV‐UHFFFAOYSA‐N |
|
| BH 625‐30 = 625M30carboxylic acid derivative |
(2RS,3RS)‐3‐[(3RS)‐1,1‐dioxo‐1λ6‐thian‐3‐yl]‐5‐oxooxolane‐2‐carboxylic acid O=S1(=O)CCCC(C1)C2CC(=O)OC2C(=O)O VCRCXRJKPGIJEV‐UHFFFAOYSA‐N |
|
| BH 517‐1 = 625M28carboxylic acid derivative |
3‐[(3RS)‐1,1‐dioxo‐1λ6‐thian‐3‐yl]pentanedioic acid O=S1(=O)CCCC(C1)C(CC(=O)O)CC(=O)O ZQTHHTAJXROHTN‐UHFFFAOYSA‐N |
|
| BH 625‐22 |
(2RS)‐2‐(4‐chlorophenoxy)propanoic acid Clc1ccc(OC(C)C(=O)O)cc1 DKHJWWRYTONYHB‐UHFFFAOYSA‐N |
|
| BH 625‐10 |
(6RS)‐6‐[(3S)‐1‐oxo‐1λ4‐thian‐3‐yl]‐2‐propyl‐6,7‐dihydro‐1,3‐benzoxazol‐4(5H)‐one O=S1CCCC(C1)C2CC(=O)c3nc(CCC)oc3C2 JITWEXSKOFSQCI‐UHFFFAOYSA‐N |
|
| BH 625‐23 |
dimethyl 3‐[(3RS)‐1,1‐dioxo‐1λ6‐thian‐3‐yl]pentanedioate O=S1(=O)CCCC(C1)C(CC(=O)OC)CC(=O)OC YZVQGYPSQUKGQX‐UHFFFAOYSA‐N |
|
SMILES: simplified molecular‐input line‐entry system
Bold: the compound name in bold has been used in this document.
ACD/Name 2015 ACD/Labs 2015 Release (File version N20E41, Build 75170, 19 December 2014).
ACD/ChemSketch 2015 ACD/Labs 2015 Release (File version C10H41, Build 75059, 17 December 2014).