5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-2-methoxy-N-methyl-benzenesulfonamide Openeye Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxy-N-methyl-benzenesulfonamide CAS Name: 5-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-2-methoxy-N-methylbenzenesulfonamide IUPAC Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxy-N-methylbenzenesulfonamide Traditional Name: 5-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-2-methoxy-N-methyl-benzenesulfonamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C20H21N3O4S2/c1-21-29(25,26)18-12-13(9-10-16(18)27-2)20(24)23-11-5-7-15(23)19-22-14-6-3-4-8-17(14)28-19/h3-4,6,8-10,12,15,21H,5,7,11H2,1-2H3