prop-2-enyl 2-[(2,2-diphenylethylamino)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[(2,2-diphenylethylamino)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate Openeye Name: allyl 4-tert-butoxycarbonylsulfanyl-2-[(2,2-diphenylethylamino)methyl]pyrrolidine-1-carboxylate CAS Name: 2-[(2,2-diphenylethylamino)methyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[(2,2-diphenylethylamino)methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate Traditional Name: 4-(tert-butoxycarbonylthio)-2-[(2,2-diphenylethylamino)methyl]pyrrolidine-1-carboxylic acid allyl ester Formula: C28H36N2O4S MolecularWeight: 496.66144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNCC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNCC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H36N2O4S/c1-5-16-33-26(31)30-20-24(35-27(32)34-28(2,3)4)17-23(30)18-29-19-25(21-12-8-6-9-13-21)22-14-10-7-11-15-22/h5-15,23-25,29H,1,16-20H2,2-4H3