prop-2-enyl 2-(phenethylcarbamoyl)-4-sulfanyl-pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl 2-(phenethylcarbamoyl)-4-sulfanyl-pyrrolidine-1-carboxylate Openeye Name: allyl 2-(phenethylcarbamoyl)-4-sulfanyl-pyrrolidine-1-carboxylate CAS Name: 4-mercapto-2-[oxo-(phenethylamino)methyl]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-(phenethylcarbamoyl)-4-sulfanylpyrrolidine-1-carboxylate Traditional Name: 4-mercapto-2-(phenethylcarbamoyl)pyrrolidine-1-carboxylic acid allyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)N1CC(CC1C(=O)NCCC2=CC=CC=C2)S

Isomeric SMILES

C=CCOC(=O)N1CC(CC1C(=O)NCCC2=CC=CC=C2)S

InChI

InChI=1S/C17H22N2O3S/c1-2-10-22-17(21)19-12-14(23)11-15(19)16(20)18-9-8-13-6-4-3-5-7-13/h2-7,14-15,23H,1,8-12H2,(H,18,20)