(3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N,N-bis(2-cyanoethyl)-1-(4-fluorophenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C17H17FN4O2 MolecularWeight: 328.340883

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)F)C(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=C(C=C2)F)C(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C17H17FN4O2/c18-14-3-5-15(6-4-14)22-12-13(11-16(22)23)17(24)21(9-1-7-19)10-2-8-20/h3-6,13H,1-2,9-12H2/t13-/m0/s1