(2S)-N-(diphenylmethyl)-1-[(phenylmethyl)carbamothioyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(diphenylmethyl)-1-[(phenylmethyl)carbamothioyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-benzhydryl-1-(benzylcarbamothioyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(diphenylmethyl)-1-[[(phenylmethyl)amino]-sulfanylidenemethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-benzhydryl-1-(benzylcarbamothioyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-benzhydryl-1-(benzylthiocarbamoyl)pyrrolidine-2-carboxamide Formula: C26H27N3OS MolecularWeight: 429.57708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=S)NCC2=CC=CC=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@H](N(C1)C(=S)NCC2=CC=CC=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3OS/c30-25(28-24(21-13-6-2-7-14-21)22-15-8-3-9-16-22)23-17-10-18-29(23)26(31)27-19-20-11-4-1-5-12-20/h1-9,11-16,23-24H,10,17-19H2,(H,27,31)(H,28,30)/t23-/m0/s1