N-[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-methyl-piperazine-1-carboxamide

Systemtic Name: N-[(3S)-1-(3-fluorophenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-methyl-piperazine-1-carboxamide Openeye Name: N-[(3S)-1-(3-fluorophenyl)-5-oxo-pyrrolidin-3-yl]-4-methyl-piperazine-1-carboxamide CAS Name: N-[(3S)-1-(3-fluorophenyl)-5-oxo-3-pyrrolidinyl]-4-methyl-1-piperazinecarboxamide IUPAC Name: N-[(3S)-1-(3-fluorophenyl)-5-oxopyrrolidin-3-yl]-4-methylpiperazine-1-carboxamide Traditional Name: N-[(3S)-1-(3-fluorophenyl)-5-keto-pyrrolidin-3-yl]-4-methyl-piperazine-1-carboxamide Formula: C16H21FN4O2 MolecularWeight: 320.361943

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC2CC(=O)N(C2)C3=CC(=CC=C3)F

Isomeric SMILES

CN1CCN(CC1)C(=O)N[C@H]2CC(=O)N(C2)C3=CC(=CC=C3)F

InChI

InChI=1S/C16H21FN4O2/c1-19-5-7-20(8-6-19)16(23)18-13-10-15(22)21(11-13)14-4-2-3-12(17)9-14/h2-4,9,13H,5-8,10-11H2,1H3,(H,18,23)/t13-/m0/s1