MLS000538673
1-(2-methylpropyl)-3-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)thiourea
Also Known As: N-isobutyl-2-(4,5,6,7-tetrahydro-1-benzothien-3-ylcarbonyl)hydrazinecarbothioamide|AK-968/41924452|1-(2-methylpropyl)-3-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)thiourea|N-({[(2-methylpropyl)amino]thioxomethyl}amino)-4,5,6,7-tetrahydrobenzo[b]thiop hen-3-ylcarboxamide|N-(2-methylpropyl)-2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)hydrazinecarbothioamide
| Molecular Formula | C14H21N3OS2 |
|---|---|
| Molecular Weight | 311.1126 g/mol |
| LogP | 2.3918 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.1126 |
| Monoisotopic Mass | 311.1126 |
| Heavy Atoms | 20 |
| Complexity | 496.6085 |
Chemical Identifiers
| CAS Number | 438232-93-0 |
|---|---|
| SMILES | CC(C)CNC(=S)NNC(=O)C1=CSC2=C1CCCC2 |
Product Overview
MLS000538673 (CAS 438232-93-0), with molecular formula C14H21N3OS2 and molecular weight 311.1126 g/mol. IUPAC: 1-(2-methylpropyl)-3-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)thiourea.
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