8-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-7-methyl-quinoline

Systemtic Name: 8-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-7-methyl-quinoline Openeye Name: 8-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-7-methyl-quinoline CAS Name: 8-[[1-(3-chloro-4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]oxy]-7-methylquinoline IUPAC Name: 8-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-7-methylquinoline Traditional Name: 8-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]oxy-7-methyl-quinoline Formula: C22H16ClN5O MolecularWeight: 401.84834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=C(C=CC5=C4N=CC=C5)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=C(C=CC5=C4N=CC=C5)C)Cl

InChI

InChI=1S/C22H16ClN5O/c1-13-6-8-16(10-18(13)23)28-21-17(11-27-28)22(26-12-25-21)29-20-14(2)5-7-15-4-3-9-24-19(15)20/h3-12H,1-2H3