N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethyl-1-pyrazolyl]acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethylpyrazol-1-yl]acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(dimethylsulfamoyl)-3,5-dimethyl-pyrazol-1-yl]acetamide Formula: C21H31N5O5S2 MolecularWeight: 497.63134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)C)S(=O)(=O)N(C)C

InChI

InChI=1S/C21H31N5O5S2/c1-16-21(33(30,31)24(3)4)17(2)26(23-16)15-20(27)22-18-9-11-19(12-10-18)32(28,29)25-13-7-5-6-8-14-25/h9-12H,5-8,13-15H2,1-4H3,(H,22,27)