5-[[2-azanyl-6-(5-chloranyl-2-methyl-phenyl)pyrimidin-4-yl]amino]isoindole-1,3-dione

Systemtic Name: 5-[[2-azanyl-6-(5-chloranyl-2-methyl-phenyl)pyrimidin-4-yl]amino]isoindole-1,3-dione Openeye Name: 5-[[2-amino-6-(5-chloro-2-methyl-phenyl)pyrimidin-4-yl]amino]isoindoline-1,3-dione CAS Name: 5-[[2-amino-6-(5-chloro-2-methylphenyl)-4-pyrimidinyl]amino]isoindole-1,3-dione IUPAC Name: 5-[[2-amino-6-(5-chloro-2-methylphenyl)pyrimidin-4-yl]amino]isoindole-1,3-dione Traditional Name: 5-[[2-amino-6-(5-chloro-2-methyl-phenyl)pyrimidin-4-yl]amino]isoindoline-1,3-quinone Formula: C19H14ClN5O2 MolecularWeight: 379.79976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)C(=O)NC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)C2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)C(=O)NC4=O

InChI

InChI=1S/C19H14ClN5O2/c1-9-2-3-10(20)6-13(9)15-8-16(24-19(21)23-15)22-11-4-5-12-14(7-11)18(27)25-17(12)26/h2-8H,1H3,(H,25,26,27)(H3,21,22,23,24)