N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]-2,6-dimethyl-phenyl]ethanamide

Systemtic Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]sulfamoyl]-2,6-dimethyl-phenyl]ethanamide Openeye Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]-2,6-dimethyl-phenyl]acetamide CAS Name: N-[4-[[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]sulfamoyl]-2,6-dimethylphenyl]acetamide IUPAC Name: N-[4-[[2-(azepan-1-yl)-2-thiophen-3-ylethyl]sulfamoyl]-2,6-dimethylphenyl]acetamide Traditional Name: N-[4-[[2-(azepan-1-yl)-2-(3-thienyl)ethyl]sulfamoyl]-2,6-dimethyl-phenyl]acetamide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C)C)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C)C)S(=O)(=O)NCC(C2=CSC=C2)N3CCCCCC3

InChI

InChI=1S/C22H31N3O3S2/c1-16-12-20(13-17(2)22(16)24-18(3)26)30(27,28)23-14-21(19-8-11-29-15-19)25-9-6-4-5-7-10-25/h8,11-13,15,21,23H,4-7,9-10,14H2,1-3H3,(H,24,26)