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

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-phenylphenyl)butanoic acid Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-phenylphenyl)butanoic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)amino]-3-(4-phenylphenyl)butanoic acid IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-phenylphenyl)butanoic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-3-(4-phenylphenyl)butyric acid Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O2/c1-14-13-15(2)24-22(23-14)25-20(21(26)27)16(3)17-9-11-19(12-10-17)18-7-5-4-6-8-18/h4-13,16,20H,1-3H3,(H,26,27)(H,23,24,25)