2-[(5-methyl-4-phenyl-1,2,3-triazol-1-yl)methyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[(5-methyl-4-phenyl-1,2,3-triazol-1-yl)methyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylic acid Openeye Name: 2-[(5-methyl-4-phenyl-triazol-1-yl)methyl]-4-tritylsulfanyl-pyrrolidine-1-carboxylic acid CAS Name: 2-[(5-methyl-4-phenyl-1-triazolyl)methyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[(5-methyl-4-phenyltriazol-1-yl)methyl]-4-tritylsulfanylpyrrolidine-1-carboxylic acid Traditional Name: 2-[(5-methyl-4-phenyl-triazol-1-yl)methyl]-4-(tritylthio)pyrrolidine-1-carboxylic acid Formula: C34H32N4O2S MolecularWeight: 560.70848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC2CC(CN2C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=C(N=NN1CC2CC(CN2C(=O)O)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H32N4O2S/c1-25-32(26-14-6-2-7-15-26)35-36-38(25)23-30-22-31(24-37(30)33(39)40)41-34(27-16-8-3-9-17-27,28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,30-31H,22-24H2,1H3,(H,39,40)