2-[4-[(phenylmethyl)-(1,3-thiazol-2-yl)amino]phenyl]propanoic acid

Systemtic Name: 2-[4-[(phenylmethyl)-(1,3-thiazol-2-yl)amino]phenyl]propanoic acid Openeye Name: 2-[4-[benzyl(thiazol-2-yl)amino]phenyl]propanoic acid CAS Name: 2-[4-[(phenylmethyl)-(2-thiazolyl)amino]phenyl]propanoic acid IUPAC Name: 2-[4-[benzyl(1,3-thiazol-2-yl)amino]phenyl]propanoic acid Traditional Name: 2-[4-[benzyl(thiazol-2-yl)amino]phenyl]propionic acid Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N(CC2=CC=CC=C2)C3=NC=CS3)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)N(CC2=CC=CC=C2)C3=NC=CS3)C(=O)O

InChI

InChI=1S/C19H18N2O2S/c1-14(18(22)23)16-7-9-17(10-8-16)21(19-20-11-12-24-19)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3,(H,22,23)