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

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-N-(3,3-diphenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-N-(3,3-diphenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(3-chloro-4-methylphenyl)-N-(3,3-diphenylpropyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(3-chloro-4-methylphenyl)-N-(3,3-diphenylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-(3,3-diphenylpropyl)amine Formula: C27H24ClN5 MolecularWeight: 453.96596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NCCC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C27H24ClN5/c1-19-12-13-22(16-25(19)28)33-27-24(17-32-33)26(30-18-31-27)29-15-14-23(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-13,16-18,23H,14-15H2,1H3,(H,29,30,31)