1-(5-chloranyl-2-methyl-phenyl)-N-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-N-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-N-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(5-chloro-2-methylphenyl)-N-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(5-chloro-2-methylphenyl)-N-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(5-chloro-2-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(4-fluorophenyl)amine Formula: C18H13ClFN5 MolecularWeight: 353.780723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NC4=CC=C(C=C4)F

InChI

InChI=1S/C18H13ClFN5/c1-11-2-3-12(19)8-16(11)25-18-15(9-23-25)17(21-10-22-18)24-14-6-4-13(20)5-7-14/h2-10H,1H3,(H,21,22,24)