2-(furan-2-yl)-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid

Systemtic Name: 2-(furan-2-yl)-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-2-(2-furyl)propanoic acid CAS Name: 2-(2-furanyl)-2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]-2-(furan-2-yl)propanoic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]-2-(2-furyl)propionic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)(C(=O)O)NC(=O)C(CC2=CC=CC=C2)CS

Isomeric SMILES

CC(C1=CC=CO1)(C(=O)O)NC(=O)C(CC2=CC=CC=C2)CS

InChI

InChI=1S/C17H19NO4S/c1-17(16(20)21,14-8-5-9-22-14)18-15(19)13(11-23)10-12-6-3-2-4-7-12/h2-9,13,23H,10-11H2,1H3,(H,18,19)(H,20,21)