2-azanyl-3-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-oxo-2-(3-phenylpropylamino)ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-oxo-2-(3-phenylpropylamino)ethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-oxo-2-(3-phenylpropylamino)ethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-(3-phenylpropylamino)ethyl]thio]propionic acid Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CSCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C14H20N2O3S/c15-12(14(18)19)9-20-10-13(17)16-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10,15H2,(H,16,17)(H,18,19)