2-[[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[(5-benzyl-2,6-dimethylpyrimidin-4-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)amino]-4-methyl-valeric acid Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O2/c1-12(2)10-17(19(23)24)22-18-16(13(3)20-14(4)21-18)11-15-8-6-5-7-9-15/h5-9,12,17H,10-11H2,1-4H3,(H,23,24)(H,20,21,22)