2-[(2-oxidanylidenepyrrolidin-1-yl)carbonylcarbamothioylamino]-2-phenyl-ethanoic acid

Systemtic Name: 2-[(2-oxidanylidenepyrrolidin-1-yl)carbonylcarbamothioylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[(2-oxopyrrolidine-1-carbonyl)carbamothioylamino]-2-phenyl-acetic acid CAS Name: 2-[[[[oxo-(2-oxo-1-pyrrolidinyl)methyl]amino]-sulfanylidenemethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[(2-oxopyrrolidine-1-carbonyl)carbamothioylamino]-2-phenylacetic acid Traditional Name: 2-[(2-ketopyrrolidine-1-carbonyl)thiocarbamoylamino]-2-phenyl-acetic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4S/c18-10-7-4-8-17(10)14(21)16-13(22)15-11(12(19)20)9-5-2-1-3-6-9/h1-3,5-6,11H,4,7-8H2,(H,19,20)(H2,15,16,21,22)