N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzenesulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,5-dimethyl-benzenesulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2,5-dimethylbenzenesulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2,5-dimethylbenzenesulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2,5-dimethyl-benzenesulfonamide Formula: C18H21ClN2O4S2 MolecularWeight: 428.95334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H21ClN2O4S2/c1-13-5-6-14(2)17(11-13)26(22,23)20-15-7-8-16(19)18(12-15)27(24,25)21-9-3-4-10-21/h5-8,11-12,20H,3-4,9-10H2,1-2H3