(2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]propanamide

Systemtic Name: (2S)-2-(3-oxidanylidene-1H-isoindol-2-yl)-3-phenyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]propanamide Openeye Name: (2S)-2-(1-oxoisoindolin-2-yl)-3-phenyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]propanamide CAS Name: (2S)-2-(3-oxo-1H-isoindol-2-yl)-3-phenyl-N-[4-(1-pyrrolidinylmethyl)phenyl]propanamide IUPAC Name: (2S)-2-(3-oxo-1H-isoindol-2-yl)-3-phenyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]propanamide Traditional Name: (2S)-2-(1-ketoisoindolin-2-yl)-3-phenyl-N-[4-(pyrrolidinomethyl)phenyl]propionamide Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)NC(=O)C(CC3=CC=CC=C3)N4CC5=CC=CC=C5C4=O

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)NC(=O)[C@H](CC3=CC=CC=C3)N4CC5=CC=CC=C5C4=O

InChI

InChI=1S/C28H29N3O2/c32-27(29-24-14-12-22(13-15-24)19-30-16-6-7-17-30)26(18-21-8-2-1-3-9-21)31-20-23-10-4-5-11-25(23)28(31)33/h1-5,8-15,26H,6-7,16-20H2,(H,29,32)/t26-/m0/s1