2-(2-cyanophenyl)sulfanyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(2-cyanophenyl)sulfanyl-benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-(2-cyanophenyl)sulfanylbenzamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-3-yl]-2-[(2-cyanophenyl)thio]benzamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)CC4=CC=CC=C4

Isomeric SMILES

C1CN(C[C@@H]1NC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)CC4=CC=CC=C4

InChI

InChI=1S/C25H23N3OS/c26-16-20-10-4-6-12-23(20)30-24-13-7-5-11-22(24)25(29)27-21-14-15-28(18-21)17-19-8-2-1-3-9-19/h1-13,21H,14-15,17-18H2,(H,27,29)/t21-/m1/s1