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

Systemtic Name: (2S)-2-[[2,6-dimethyl-5-(phenylmethyl)pyrimidin-4-yl]amino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2,6-dimethyl-5-(phenylmethyl)-4-pyrimidinyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(5-benzyl-2,6-dimethylpyrimidin-4-yl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)amino]-4-methyl-valerate Formula: C19H24N3O2- MolecularWeight: 326.41276

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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)N[C@@H](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)/p-1/t17-/m0/s1