2-[methyl-(phenylmethyl)carbamoyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[methyl-(phenylmethyl)carbamoyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylic acid Openeye Name: 2-[benzyl(methyl)carbamoyl]-4-tritylsulfanyl-pyrrolidine-1-carboxylic acid CAS Name: 2-[[methyl-(phenylmethyl)amino]-oxomethyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[benzyl(methyl)carbamoyl]-4-tritylsulfanylpyrrolidine-1-carboxylic acid Traditional Name: 2-[benzyl(methyl)carbamoyl]-4-(tritylthio)pyrrolidine-1-carboxylic acid Formula: C33H32N2O3S MolecularWeight: 536.68378

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2CC(CN2C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2CC(CN2C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H32N2O3S/c1-34(23-25-14-6-2-7-15-25)31(36)30-22-29(24-35(30)32(37)38)39-33(26-16-8-3-9-17-26,27-18-10-4-11-19-27)28-20-12-5-13-21-28/h2-21,29-30H,22-24H2,1H3,(H,37,38)