4-methyl-2-[(6-propyl-2-quinolin-3-yl-pyrimidin-4-yl)amino]pentanoic acid

Systemtic Name: 4-methyl-2-[(6-propyl-2-quinolin-3-yl-pyrimidin-4-yl)amino]pentanoic acid Openeye Name: 4-methyl-2-[[6-propyl-2-(3-quinolyl)pyrimidin-4-yl]amino]pentanoic acid CAS Name: 4-methyl-2-[[6-propyl-2-(3-quinolinyl)-4-pyrimidinyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[(6-propyl-2-quinolin-3-ylpyrimidin-4-yl)amino]pentanoic acid Traditional Name: 4-methyl-2-[[6-propyl-2-(3-quinolyl)pyrimidin-4-yl]amino]valeric acid Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)C2=CC3=CC=CC=C3N=C2)NC(CC(C)C)C(=O)O

Isomeric SMILES

CCCC1=CC(=NC(=N1)C2=CC3=CC=CC=C3N=C2)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C22H26N4O2/c1-4-7-17-12-20(25-19(22(27)28)10-14(2)3)26-21(24-17)16-11-15-8-5-6-9-18(15)23-13-16/h5-6,8-9,11-14,19H,4,7,10H2,1-3H3,(H,27,28)(H,24,25,26)