2-[1-methylsulfanyl-3-oxidanylidene-3-(phenethylamino)propyl]pyrrolidine-1-carboxylic acid

Systemtic Name: 2-[1-methylsulfanyl-3-oxidanylidene-3-(phenethylamino)propyl]pyrrolidine-1-carboxylic acid Openeye Name: 2-[1-methylsulfanyl-3-oxo-3-(phenethylamino)propyl]pyrrolidine-1-carboxylic acid CAS Name: 2-[1-(methylthio)-3-oxo-3-(phenethylamino)propyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-[1-methylsulfanyl-3-oxo-3-(phenethylamino)propyl]pyrrolidine-1-carboxylic acid Traditional Name: 2-[3-keto-1-(methylthio)-3-(phenethylamino)propyl]pyrrolidine-1-carboxylic acid Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(=O)NCCC1=CC=CC=C1)C2CCCN2C(=O)O

Isomeric SMILES

CSC(CC(=O)NCCC1=CC=CC=C1)C2CCCN2C(=O)O

InChI

InChI=1S/C17H24N2O3S/c1-23-15(14-8-5-11-19(14)17(21)22)12-16(20)18-10-9-13-6-3-2-4-7-13/h2-4,6-7,14-15H,5,8-12H2,1H3,(H,18,20)(H,21,22)