prop-2-enyl (2S,4S)-2-pyridin-4-yl-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-pyridin-4-yl-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-(4-pyridyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-pyridin-4-yl-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-pyridin-4-yl-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-(4-pyridyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C32H30N2O2S MolecularWeight: 506.6578

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1C2=CC=NC=C2)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CCOC(=O)N1C[C@H](C[C@H]1C2=CC=NC=C2)SC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H30N2O2S/c1-2-22-36-31(35)34-24-29(23-30(34)25-18-20-33-21-19-25)37-32(26-12-6-3-7-13-26,27-14-8-4-9-15-27)28-16-10-5-11-17-28/h2-21,29-30H,1,22-24H2/t29-,30-/m0/s1