2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-phenylphenyl)propanoic acid

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-phenylphenyl)propanoic acid Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-phenylphenyl)propanoic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-(3-phenylphenyl)propanoic acid IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-phenylphenyl)propanoic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(3-phenylphenyl)propionic acid Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)O)C

InChI

InChI=1S/C21H21N3O2/c1-14-11-15(2)23-21(22-14)24-19(20(25)26)13-16-7-6-10-18(12-16)17-8-4-3-5-9-17/h3-12,19H,13H2,1-2H3,(H,25,26)(H,22,23,24)