N-[(E)-3-(4-Chlorophenyl)Prop-2-Enyl]-N-[2-(Isoquinolin-5-Ylsulfonylamino)Ethyl]Formamide
[CAS# 130964-32-8]

Identification

• Name: N-[(E)-3-(4-Chlorophenyl)Prop-2-Enyl]-N-[2-(Isoquinolin-5-Ylsulfonylamino)Ethyl]Formamide
• Synonyms: N-[(E)-3-(4-Chlorophenyl)Prop-2-Enyl]-N-[2-(5-Isoquinolylsulfonylamino)Ethyl]Formamide; N-[(E)-3-(4-Chlorophenyl)Prop-2-Enyl]-N-[2-(Isoquinolin-5-Ylsulfonylamino)Ethyl]Methanamide; N-(2-(N-Formyl-N-(3-(4-Chlorophenyl)-2-Propenyl)Amino)Ethyl)-5-Isoquinolinesulfonamide
• Molecular Formula: C₂₁H₂₀ClN₃O₃S
• Molecular Weight: 429.92
• CAS Registry Number: 130964-32-8
• SMILES: C1=CC(=CC=C1Cl)\C=C\CN(CCN[S](=O)(=O)C3=C2C=CN=CC2=CC=C3)C=O
• InChI: 1S/C21H20ClN3O3S/c22-19-8-6-17(7-9-19)3-2-13-25(16-26)14-12-24-29(27,28)21-5-1-4-18-15-23-11-10-20(18)21/h1-11,15-16,24H,12-14H2/b3-2+
• InChIKey: XUXRTHZFSNFHQA-NSCUHMNNSA-N

Properties

• Density: 1.349g/cm³ (Cal.)
• Boiling point: 708.099°C at 760 mmHg (Cal.)
• Flash point: 382.045°C (Cal.)