N-[1-(2,5-dimethylphenyl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[1-(2,5-dimethylphenyl)ethyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C20H26N2O4S2 MolecularWeight: 422.56144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O4S2/c1-15-6-7-16(2)20(14-15)17(3)21-27(23,24)18-8-10-19(11-9-18)28(25,26)22-12-4-5-13-22/h6-11,14,17,21H,4-5,12-13H2,1-3H3