Oprea1_096869
1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea
Also Known As: Oprea1_096869|N-(5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-N'-(4-ethoxyphenyl)urea|AO-022/43453452|1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea|1-(5-(((4-chlorobenzyl)thio)methyl)-1,3,4-thiadiazol-2-yl)-3-(4-ethoxyphenyl)urea|3-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-1-(4-ethoxyphenyl)urea|1-[(2E)-5-{[(4-chlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-ethoxyphenyl)urea|3-[5-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-1,3,4-thiadiazol-2-yl]-1-(4-ethoxyphenyl)urea
| Molecular Formula | C19H19ClN4O2S2 |
|---|---|
| Molecular Weight | 434.06378 g/mol |
| LogP | 5.6676 |
| Topological Polar Surface Area | 76.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 434.06378 |
| Monoisotopic Mass | 434.06378 |
| Heavy Atoms | 28 |
| Complexity | 901.0569 |
Chemical Identifiers
| CAS Number | 426249-99-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=C(C=C3)Cl |
Product Overview
Oprea1_096869 (CAS 426249-99-2), with molecular formula C19H19ClN4O2S2 and molecular weight 434.06378 g/mol. IUPAC: 1-[5-[(4-chlorophenyl)methylsulfanylmethyl]-1,3,4-thiadiazol-2-yl]-3-(4-ethoxyphenyl)urea.
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