3-[3-oxidanylidene-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-oxidanylidene-3-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]amino]propyl]sulfanylpropanoic acid Openeye Name: 3-[3-oxo-3-[4-(2-oxopyrrolidin-1-yl)anilino]propyl]sulfanylpropanoic acid CAS Name: 3-[[3-oxo-3-[4-(2-oxo-1-pyrrolidinyl)anilino]propyl]thio]propanoic acid IUPAC Name: 3-[3-oxo-3-[4-(2-oxopyrrolidin-1-yl)anilino]propyl]sulfanylpropanoic acid Traditional Name: 3-[[3-keto-3-[4-(2-ketopyrrolidino)anilino]propyl]thio]propionic acid Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CCSCCC(=O)O

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)CCSCCC(=O)O

InChI

InChI=1S/C16H20N2O4S/c19-14(7-10-23-11-8-16(21)22)17-12-3-5-13(6-4-12)18-9-1-2-15(18)20/h3-6H,1-2,7-11H2,(H,17,19)(H,21,22)