prop-2-enyl 2-[[3-methylbutanoyl(2-naphthalen-1-ylethyl)amino]methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[[3-methylbutanoyl(2-naphthalen-1-ylethyl)amino]methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate Openeye Name: allyl 4-tert-butoxycarbonylsulfanyl-2-[[3-methylbutanoyl-[2-(1-naphthyl)ethyl]amino]methyl]pyrrolidine-1-carboxylate CAS Name: 2-[[(3-methyl-1-oxobutyl)-[2-(1-naphthalenyl)ethyl]amino]methyl]-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[3-methylbutanoyl(2-naphthalen-1-ylethyl)amino]methyl]-4-[(2-methylpropan-2-yl)oxycarbonylsulfanyl]pyrrolidine-1-carboxylate Traditional Name: 4-(tert-butoxycarbonylthio)-2-[[isovaleryl-[2-(1-naphthyl)ethyl]amino]methyl]pyrrolidine-1-carboxylic acid allyl ester Formula: C31H42N2O5S MolecularWeight: 554.74058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N(CCC1=CC=CC2=CC=CC=C21)CC3CC(CN3C(=O)OCC=C)SC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC(=O)N(CCC1=CC=CC2=CC=CC=C21)CC3CC(CN3C(=O)OCC=C)SC(=O)OC(C)(C)C

InChI

InChI=1S/C31H42N2O5S/c1-7-17-37-29(35)33-21-26(39-30(36)38-31(4,5)6)19-25(33)20-32(28(34)18-22(2)3)16-15-24-13-10-12-23-11-8-9-14-27(23)24/h7-14,22,25-26H,1,15-21H2,2-6H3