2-(2-cyanophenyl)sulfanyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-(2-phenyl-2-pyrrolidino-ethyl)benzamide Formula: C26H25N3OS MolecularWeight: 427.5612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3OS/c27-18-21-12-4-6-14-24(21)31-25-15-7-5-13-22(25)26(30)28-19-23(29-16-8-9-17-29)20-10-2-1-3-11-20/h1-7,10-15,23H,8-9,16-17,19H2,(H,28,30)