prop-2-enyl 2-[2-(4-cyanoimidazol-1-yl)ethyl]-4-ethanoylsulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-[2-(4-cyanoimidazol-1-yl)ethyl]-4-ethanoylsulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 4-acetylsulfanyl-2-[2-(4-cyanoimidazol-1-yl)ethyl]pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-[2-(4-cyano-1-imidazolyl)ethyl]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-acetylsulfanyl-2-[2-(4-cyanoimidazol-1-yl)ethyl]pyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-[2-(4-cyanoimidazol-1-yl)ethyl]pyrrolidine-1-carboxylic acid allyl ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)OCC=C)CCN2C=C(N=C2)C#N

Isomeric SMILES

CC(=O)SC1CC(N(C1)C(=O)OCC=C)CCN2C=C(N=C2)C#N

InChI

InChI=1S/C16H20N4O3S/c1-3-6-23-16(22)20-10-15(24-12(2)21)7-14(20)4-5-19-9-13(8-17)18-11-19/h3,9,11,14-15H,1,4-7,10H2,2H3