2-[(2-acetamido-3-phenyl-propanoyl)-(2H-thiopyran-3-yl)amino]propanoic acid

Systemtic Name: 2-[(2-acetamido-3-phenyl-propanoyl)-(2H-thiopyran-3-yl)amino]propanoic acid Openeye Name: 2-[(2-acetamido-3-phenyl-propanoyl)-(2H-thiopyran-3-yl)amino]propanoic acid CAS Name: 2-[(2-acetamido-1-oxo-3-phenylpropyl)-(2H-thiopyran-3-yl)amino]propanoic acid IUPAC Name: 2-[(2-acetamido-3-phenylpropanoyl)-(2H-thiopyran-3-yl)amino]propanoic acid Traditional Name: 2-[(2-acetamido-3-phenyl-propanoyl)-(2H-thiopyran-3-yl)amino]propionic acid Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC=CSC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CC(C(=O)O)N(C1=CC=CSC1)C(=O)C(CC2=CC=CC=C2)NC(=O)C

InChI

InChI=1S/C19H22N2O4S/c1-13(19(24)25)21(16-9-6-10-26-12-16)18(23)17(20-14(2)22)11-15-7-4-3-5-8-15/h3-10,13,17H,11-12H2,1-2H3,(H,20,22)(H,24,25)