(phenylmethyl) (2S)-1-[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S)-1-[(2S)-2-azanyl-4-methylsulfanyl-butanoyl]pyrrolidine-2-carboxylate Openeye Name: benzyl (2S)-1-[(2S)-2-amino-4-methylsulfanyl-butanoyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[(2S)-2-amino-4-(methylthio)-1-oxobutyl]-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-1-[(2S)-2-amino-4-methylsulfanylbutanoyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[(2S)-2-amino-4-(methylthio)butanoyl]pyrrolidine-2-carboxylic acid benzyl ester Formula: C17H24N2O3S MolecularWeight: 336.44906

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCC1C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCC[C@H]1C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C17H24N2O3S/c1-23-11-9-14(18)16(20)19-10-5-8-15(19)17(21)22-12-13-6-3-2-4-7-13/h2-4,6-7,14-15H,5,8-12,18H2,1H3/t14-,15-/m0/s1