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

Systemtic Name: prop-2-enyl 4-ethanoylsulfanyl-2-(imidazol-1-ylmethyl)pyrrolidine-1-carboxylate Openeye Name: allyl 4-acetylsulfanyl-2-(imidazol-1-ylmethyl)pyrrolidine-1-carboxylate CAS Name: 4-(acetylthio)-2-(1-imidazolylmethyl)-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-acetylsulfanyl-2-(imidazol-1-ylmethyl)pyrrolidine-1-carboxylate Traditional Name: 4-(acetylthio)-2-(imidazol-1-ylmethyl)pyrrolidine-1-carboxylic acid allyl ester Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C(=O)OCC=C)CN2C=CN=C2

Isomeric SMILES

CC(=O)SC1CC(N(C1)C(=O)OCC=C)CN2C=CN=C2

InChI

InChI=1S/C14H19N3O3S/c1-3-6-20-14(19)17-9-13(21-11(2)18)7-12(17)8-16-5-4-15-10-16/h3-5,10,12-13H,1,6-9H2,2H3