N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]-2-fluoranyl-phenyl]ethanamide

Systemtic Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]-2-fluoranyl-phenyl]ethanamide Openeye Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]-2-fluoro-phenyl]acetamide CAS Name: N-[4-[[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]sulfamoyl]-2-fluorophenyl]acetamide IUPAC Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-ylethyl]sulfamoyl]-2-fluorophenyl]acetamide Traditional Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]-2-fluoro-phenyl]acetamide Formula: C20H26FN3O3S2 MolecularWeight: 439.567143

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3)F

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3)F

InChI

InChI=1S/C20H26FN3O3S2/c1-15(25)23-19-7-6-17(12-18(19)21)29(26,27)22-13-20(16-8-11-28-14-16)24-9-4-2-3-5-10-24/h6-8,11-12,14,20,22H,2-5,9-10,13H2,1H3,(H,23,25)