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

Systemtic Name: 3-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-N-methyl-N-phenyl-benzenesulfonamide Openeye Name: 3-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N-methyl-N-phenyl-benzenesulfonamide CAS Name: 3-[[(2S)-2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-N-methyl-N-phenylbenzenesulfonamide IUPAC Name: 3-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N-methyl-N-phenylbenzenesulfonamide Traditional Name: 3-[(2S)-2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-N-methyl-N-phenyl-benzenesulfonamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC[C@H]3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C25H23N3O3S2/c1-27(19-10-3-2-4-11-19)33(30,31)20-12-7-9-18(17-20)25(29)28-16-8-14-22(28)24-26-21-13-5-6-15-23(21)32-24/h2-7,9-13,15,17,22H,8,14,16H2,1H3/t22-/m0/s1