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

Systemtic Name: 2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]-thiophen-2-yl-amino]propanoic acid Openeye Name: 2-[(2-benzyl-3-sulfanyl-propanoyl)-(2-thienyl)amino]propanoic acid CAS Name: 2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]-thiophen-2-ylamino]propanoic acid IUPAC Name: 2-[(2-benzyl-3-sulfanylpropanoyl)-thiophen-2-ylamino]propanoic acid Traditional Name: 2-[(2-benzyl-3-mercapto-propanoyl)-(2-thienyl)amino]propionic acid Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CS1)C(=O)C(CC2=CC=CC=C2)CS

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CS1)C(=O)C(CC2=CC=CC=C2)CS

InChI

InChI=1S/C17H19NO3S2/c1-12(17(20)21)18(15-8-5-9-23-15)16(19)14(11-22)10-13-6-3-2-4-7-13/h2-9,12,14,22H,10-11H2,1H3,(H,20,21)