prop-2-enyl 2-(cyanomethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-(cyanomethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 2-(cyanomethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: 2-(cyanomethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(cyanomethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: 2-(cyanomethyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C29H28N2O2S MolecularWeight: 468.60982

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1CC#N)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C=CCOC(=O)N1CC(CC1CC#N)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H28N2O2S/c1-2-20-33-28(32)31-22-27(21-26(31)18-19-30)34-29(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h2-17,26-27H,1,18,20-22H2