1-[2-[(diphenylmethyl)sulfanylmethyl]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(diphenylmethyl)sulfanylmethyl]-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(benzhydrylsulfanylmethyl)-3-phenyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[(diphenylmethyl)thio]methyl]-1-oxo-3-phenylpropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(benzhydrylsulfanylmethyl)-3-phenylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(benzhydrylthio)methyl]-3-phenyl-propanoyl]proline Formula: C28H29NO3S MolecularWeight: 459.59976

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)CSC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)CSC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H29NO3S/c30-27(29-18-10-17-25(29)28(31)32)24(19-21-11-4-1-5-12-21)20-33-26(22-13-6-2-7-14-22)23-15-8-3-9-16-23/h1-9,11-16,24-26H,10,17-20H2,(H,31,32)