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

Systemtic Name: prop-2-enyl 4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]-2-[(2-naphthalen-1-ylethylamino)methyl]pyrrolidine-1-carboxylate Openeye Name: allyl 4-tert-butoxycarbonylsulfanyl-2-[[2-(1-naphthyl)ethylamino]methyl]pyrrolidine-1-carboxylate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]-2-[[2-(1-naphthalenyl)ethylamino]methyl]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]-2-[(2-naphthalen-1-ylethylamino)methyl]pyrrolidine-1-carboxylate Traditional Name: 4-(tert-butoxycarbonylthio)-2-[[2-(1-naphthyl)ethylamino]methyl]pyrrolidine-1-carboxylic acid allyl ester Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNCCC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)SC1CC(N(C1)C(=O)OCC=C)CNCCC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C26H34N2O4S/c1-5-15-31-24(29)28-18-22(33-25(30)32-26(2,3)4)16-21(28)17-27-14-13-20-11-8-10-19-9-6-7-12-23(19)20/h5-12,21-22,27H,1,13-18H2,2-4H3