N-(3,5-dimethylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(3,5-dimethylphenyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-(3,5-dimethylphenyl)-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(3,5-dimethylphenyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(3,5-dimethylphenyl)-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C18H22N2O4S2 MolecularWeight: 394.50828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C18H22N2O4S2/c1-14-11-15(2)13-16(12-14)19-25(21,22)17-5-7-18(8-6-17)26(23,24)20-9-3-4-10-20/h5-8,11-13,19H,3-4,9-10H2,1-2H3