N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-[(3,4-dimethylphenyl)sulfonylamino]acetamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C22H29N3O5S2/c1-17-10-11-20(14-18(17)2)31(27,28)23-16-22(26)24-19-8-7-9-21(15-19)32(29,30)25-12-5-3-4-6-13-25/h7-11,14-15,23H,3-6,12-13,16H2,1-2H3,(H,24,26)