3-[[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]benzenecarbonitrile

Systemtic Name: 3-[[2-oxidanylidene-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]benzenecarbonitrile Openeye Name: 3-[[2-oxo-2-[2-(2-thienyl)pyrrolidin-1-yl]ethyl]amino]benzonitrile CAS Name: 3-[[2-oxo-2-(2-thiophen-2-yl-1-pyrrolidinyl)ethyl]amino]benzonitrile IUPAC Name: 3-[[2-oxo-2-(2-thiophen-2-ylpyrrolidin-1-yl)ethyl]amino]benzonitrile Traditional Name: 3-[[2-keto-2-[2-(2-thienyl)pyrrolidino]ethyl]amino]benzonitrile Formula: C17H17N3OS MolecularWeight: 311.40138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CNC2=CC=CC(=C2)C#N)C3=CC=CS3

Isomeric SMILES

C1CC(N(C1)C(=O)CNC2=CC=CC(=C2)C#N)C3=CC=CS3

InChI

InChI=1S/C17H17N3OS/c18-11-13-4-1-5-14(10-13)19-12-17(21)20-8-2-6-15(20)16-7-3-9-22-16/h1,3-5,7,9-10,15,19H,2,6,8,12H2