(2S)-N-(diphenylmethyl)-1-[(2-fluorophenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(diphenylmethyl)-1-[(2-fluorophenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-benzhydryl-1-[(2-fluorophenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-(diphenylmethyl)-1-[[(2-fluorophenyl)methylamino]-sulfanylidenemethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-benzhydryl-1-[(2-fluorophenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-benzhydryl-1-[(2-fluorobenzyl)thiocarbamoyl]pyrrolidine-2-carboxamide Formula: C26H26FN3OS MolecularWeight: 447.567543

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=S)NCC2=CC=CC=C2F)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=S)NCC2=CC=CC=C2F)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26FN3OS/c27-22-15-8-7-14-21(22)18-28-26(32)30-17-9-16-23(30)25(31)29-24(19-10-3-1-4-11-19)20-12-5-2-6-13-20/h1-8,10-15,23-24H,9,16-18H2,(H,28,32)(H,29,31)/t23-/m0/s1