(phenylmethyl) 1-[2-[(triphenylmethyl)amino]-3-(triphenylmethyl)sulfanyl-propanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) 1-[2-[(triphenylmethyl)amino]-3-(triphenylmethyl)sulfanyl-propanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl 1-[2-(tritylamino)-3-tritylsulfanyl-propanoyl]pyrrolidine-2-carboxylate CAS Name: 1-[1-oxo-2-[(triphenylmethyl)amino]-3-[(triphenylmethyl)thio]propyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[2-(tritylamino)-3-tritylsulfanylpropanoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[2-(tritylamino)-3-(tritylthio)propanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C53H48N2O3S MolecularWeight: 793.02482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)OCC8=CC=CC=C8

Isomeric SMILES

C1CC(N(C1)C(=O)C(CSC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C(=O)OCC8=CC=CC=C8

InChI

InChI=1S/C53H48N2O3S/c56-50(55-38-22-37-49(55)51(57)58-39-41-23-8-1-9-24-41)48(54-52(42-25-10-2-11-26-42,43-27-12-3-13-28-43)44-29-14-4-15-30-44)40-59-53(45-31-16-5-17-32-45,46-33-18-6-19-34-46)47-35-20-7-21-36-47/h1-21,23-36,48-49,54H,22,37-40H2