1-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline

Systemtic Name: 1-[1-(3-chloranyl-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Openeye Name: 1-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline CAS Name: 1-[1-(3-chloro-4-methylphenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-3,4-dihydro-2H-quinoline IUPAC Name: 1-[1-(3-chloro-4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Traditional Name: 1-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-3,4-dihydro-2H-quinoline Formula: C21H18ClN5 MolecularWeight: 375.85412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N4CCCC5=CC=CC=C54)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N4CCCC5=CC=CC=C54)Cl

InChI

InChI=1S/C21H18ClN5/c1-14-8-9-16(11-18(14)22)27-21-17(12-25-27)20(23-13-24-21)26-10-4-6-15-5-2-3-7-19(15)26/h2-3,5,7-9,11-13H,4,6,10H2,1H3