prop-2-enyl (2S,4S)-2-[3-[methyl(prop-2-enoxycarbonyl)amino]prop-1-ynyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-[3-[methyl(prop-2-enoxycarbonyl)amino]prop-1-ynyl]-4-(triphenylmethyl)sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-[3-[allyloxycarbonyl(methyl)amino]prop-1-ynyl]-4-tritylsulfanyl-pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-[3-[methyl-[oxo(prop-2-enoxy)methyl]amino]prop-1-ynyl]-4-[(triphenylmethyl)thio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-[3-[methyl(prop-2-enoxycarbonyl)amino]prop-1-ynyl]-4-tritylsulfanylpyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-[3-[allyloxycarbonyl(methyl)amino]prop-1-ynyl]-4-(tritylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C35H36N2O4S MolecularWeight: 580.73634

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#CC1CC(CN1C(=O)OCC=C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC=C

Isomeric SMILES

CN(CC#C[C@@H]1C[C@@H](CN1C(=O)OCC=C)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC=C

InChI

InChI=1S/C35H36N2O4S/c1-4-24-40-33(38)36(3)23-15-22-31-26-32(27-37(31)34(39)41-25-5-2)42-35(28-16-9-6-10-17-28,29-18-11-7-12-19-29)30-20-13-8-14-21-30/h4-14,16-21,31-32H,1-2,23-27H2,3H3/t31-,32+/m1/s1