C20H16ClN3OS3
3-chloro-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide
Also Known As: BAS 00435408|3-chloro-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide|3-chloro-N-((3-cyano-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)carbamothioyl)benzo[b]thiophene-2-carboxamide
CAS: 477495-39-9
| Molecular Formula | C20H16ClN3OS3 |
|---|---|
| Molecular Weight | 445.0144 g/mol |
| LogP | 5.73948 |
| Topological Polar Surface Area | 64.92 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 445.0144 |
| Monoisotopic Mass | 445.0144 |
| Heavy Atoms | 28 |
| Complexity | 1141.7136 |
Chemical Identifiers
| CAS Number | 477495-39-9 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C#N)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
C20H16ClN3OS3 (CAS 477495-39-9), with molecular formula C20H16ClN3OS3 and molecular weight 445.0144 g/mol. IUPAC: 3-chloro-N-[(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamothioyl]-1-benzothiophene-2-carboxamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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