prop-2-enyl 4-ethanoylsulfanyl-2-(2-imidazol-1-ylethyl)pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 4-ethanoylsulfanyl-2-(2-imidazol-1-ylethyl)pyrrolidine-1-carboxylate Openeye Name: allyl 4-acetylsulfanyl-2-(2-imidazol-1-ylethyl)pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-[2-(1-imidazolyl)ethyl]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-acetylsulfanyl-2-(2-imidazol-1-ylethyl)pyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-(2-imidazol-1-ylethyl)pyrrolidine-1-carboxylic acid allyl ester Formula: C15H21N3O3S MolecularWeight: 323.41054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O3S/c1-3-8-21-15(20)18-10-14(22-12(2)19)9-13(18)4-6-17-7-5-16-11-17/h3,5,7,11,13-14H,1,4,6,8-10H2,2H3