N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[2-[4-(2-methyl-4-thiazolyl)phenyl]ethyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[2-[4-(2-methylthiazol-4-yl)phenyl]ethyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C22H25N3O4S3 MolecularWeight: 491.6466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H25N3O4S3/c1-17-24-22(16-30-17)19-6-4-18(5-7-19)12-13-23-31(26,27)20-8-10-21(11-9-20)32(28,29)25-14-2-3-15-25/h4-11,16,23H,2-3,12-15H2,1H3