(2R)-N-(diphenylmethyl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R)-N-(diphenylmethyl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Openeye Name: (2R)-N-benzhydryl-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide CAS Name: (2R)-N-(diphenylmethyl)-1-[[(2-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R)-N-benzhydryl-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Traditional Name: (2R)-N-benzhydryl-1-(o-anisylthiocarbamoyl)pyrrolidine-2-carboxamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=S)N2CCCC2C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CNC(=S)N2CCC[C@@H]2C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2S/c1-32-24-17-9-8-15-22(24)19-28-27(33)30-18-10-16-23(30)26(31)29-25(20-11-4-2-5-12-20)21-13-6-3-7-14-21/h2-9,11-15,17,23,25H,10,16,18-19H2,1H3,(H,28,33)(H,29,31)/t23-/m1/s1