prop-2-enyl (2R,4S)-2-(2-azanylethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2R,4S)-2-(2-azanylethyl)-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2R,4S)-2-(2-aminoethyl)-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: (2R,4S)-2-(2-aminoethyl)-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R,4S)-2-(2-aminoethyl)-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: (2R,4S)-2-(2-aminoethyl)-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C29H32N2O2S MolecularWeight: 472.64158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1CCN)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C29H32N2O2S/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,1,18-22,30H2/t26-,27+/m1/s1