2-acetamido-3-[4-methoxy-3-[2-(thiophen-2-ylamino)propanoyl]phenyl]propanoic acid

Systemtic Name: 2-acetamido-3-[4-methoxy-3-[2-(thiophen-2-ylamino)propanoyl]phenyl]propanoic acid Openeye Name: 2-acetamido-3-[4-methoxy-3-[2-(2-thienylamino)propanoyl]phenyl]propanoic acid CAS Name: 2-acetamido-3-[4-methoxy-3-[1-oxo-2-(thiophen-2-ylamino)propyl]phenyl]propanoic acid IUPAC Name: 2-acetamido-3-[4-methoxy-3-[2-(thiophen-2-ylamino)propanoyl]phenyl]propanoic acid Traditional Name: 2-acetamido-3-[4-methoxy-3-[2-(2-thienylamino)propanoyl]phenyl]propionic acid Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=C(C=CC(=C1)CC(C(=O)O)NC(=O)C)OC)NC2=CC=CS2

Isomeric SMILES

CC(C(=O)C1=C(C=CC(=C1)CC(C(=O)O)NC(=O)C)OC)NC2=CC=CS2

InChI

InChI=1S/C19H22N2O5S/c1-11(20-17-5-4-8-27-17)18(23)14-9-13(6-7-16(14)26-3)10-15(19(24)25)21-12(2)22/h4-9,11,15,20H,10H2,1-3H3,(H,21,22)(H,24,25)