(2S)-N-(1,3-diphenylpropan-2-yl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(1,3-diphenylpropan-2-yl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(1-benzyl-2-phenyl-ethyl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide CAS Name: (2S)-N-(1,3-diphenylpropan-2-yl)-1-[[(2-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(1,3-diphenylpropan-2-yl)-1-[(2-methoxyphenyl)methylcarbamothioyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(1-benzyl-2-phenyl-ethyl)-1-(o-anisylthiocarbamoyl)pyrrolidine-2-carboxamide Formula: C29H33N3O2S MolecularWeight: 487.65622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=S)N2CCCC2C(=O)NC(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CNC(=S)N2CCC[C@H]2C(=O)NC(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H33N3O2S/c1-34-27-17-9-8-15-24(27)21-30-29(35)32-18-10-16-26(32)28(33)31-25(19-22-11-4-2-5-12-22)20-23-13-6-3-7-14-23/h2-9,11-15,17,25-26H,10,16,18-21H2,1H3,(H,30,35)(H,31,33)/t26-/m0/s1