2-[[4-chloranyl-6-[(2,3-dimethylphenyl)-methyl-amino]pyrimidin-2-yl]amino]ethanoic acid

Systemtic Name: 2-[[4-chloranyl-6-[(2,3-dimethylphenyl)-methyl-amino]pyrimidin-2-yl]amino]ethanoic acid Openeye Name: 2-[[4-chloro-6-(N,2,3-trimethylanilino)pyrimidin-2-yl]amino]acetic acid CAS Name: 2-[[4-chloro-6-(N,2,3-trimethylanilino)-2-pyrimidinyl]amino]acetic acid IUPAC Name: 2-[[4-chloro-6-(N,2,3-trimethylanilino)pyrimidin-2-yl]amino]acetic acid Traditional Name: 2-[[4-chloro-6-(N,2,3-trimethylanilino)pyrimidin-2-yl]amino]acetic acid Formula: C15H17ClN4O2 MolecularWeight: 320.77408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N(C)C2=CC(=NC(=N2)NCC(=O)O)Cl)C

Isomeric SMILES

CC1=C(C(=CC=C1)N(C)C2=CC(=NC(=N2)NCC(=O)O)Cl)C

InChI

InChI=1S/C15H17ClN4O2/c1-9-5-4-6-11(10(9)2)20(3)13-7-12(16)18-15(19-13)17-8-14(21)22/h4-7H,8H2,1-3H3,(H,21,22)(H,17,18,19)