N-[[5-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide

Systemtic Name: N-[[5-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]sulfamoyl]thiophen-2-yl]methyl]ethanamide Openeye Name: N-[[5-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]sulfamoyl]-2-thienyl]methyl]acetamide CAS Name: N-[[5-[[3-(1-azepanylsulfonyl)-4-methylphenyl]sulfamoyl]-2-thiophenyl]methyl]acetamide IUPAC Name: N-[[5-[[3-(azepan-1-ylsulfonyl)-4-methylphenyl]sulfamoyl]thiophen-2-yl]methyl]acetamide Traditional Name: N-[[5-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]sulfamoyl]-2-thienyl]methyl]acetamide Formula: C20H27N3O5S3 MolecularWeight: 485.64048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(S2)CNC(=O)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=C(S2)CNC(=O)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H27N3O5S3/c1-15-7-8-17(13-19(15)31(27,28)23-11-5-3-4-6-12-23)22-30(25,26)20-10-9-18(29-20)14-21-16(2)24/h7-10,13,22H,3-6,11-12,14H2,1-2H3,(H,21,24)