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

Systemtic Name: 2-(furan-3-yl)-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]ethanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-2-(3-furyl)acetic acid CAS Name: 2-(3-furanyl)-2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]acetic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)amino]-2-(furan-3-yl)acetic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)amino]-2-(3-furyl)acetic acid Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=COC=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NC(C2=COC=C2)C(=O)O

InChI

InChI=1S/C16H17NO4S/c18-15(13(10-22)8-11-4-2-1-3-5-11)17-14(16(19)20)12-6-7-21-9-12/h1-7,9,13-14,22H,8,10H2,(H,17,18)(H,19,20)