4-(benzenesulfonyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Base Information

• Chemical Name: 4-(benzenesulfonyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide
• CAS No.: 5915-45-7
• Molecular Formula: C22H18N2O3S2
• Molecular Weight: 422.5199
• DSSTox Substance ID: DTXSID00359747
• Wikidata: Q82141082

Synonyms:5915-45-7;4-(benzenesulfonyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide;CBMicro_049846;Oprea1_253600;Oprea1_659953;SCHEMBL13532205;DTXSID00359747;BIM-0049684.P001

Chemical Property of 4-(benzenesulfonyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Chemical Property:

• Vapor Pressure: 3.55E-14mmHg at 25°C
• Boiling Point: 596.1°Cat760mmHg
• Flash Point: 314.3°C
• Density: 1.43g/cm³
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 422.07588479
• Heavy Atom Count: 29
• Complexity: 740

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)C4=CC=CC=C4)C#N

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