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

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-N-[(4-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(5-chloro-2-methyl-phenyl)-N-[(4-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(5-chloro-2-methylphenyl)-N-[(4-methoxyphenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(5-chloro-2-methylphenyl)-N-[(4-methoxyphenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(5-chloro-2-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-p-anisyl-amine Formula: C20H18ClN5O MolecularWeight: 379.84282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C3=C(C=N2)C(=NC=N3)NCC4=CC=C(C=C4)OC

InChI

InChI=1S/C20H18ClN5O/c1-13-3-6-15(21)9-18(13)26-20-17(11-25-26)19(23-12-24-20)22-10-14-4-7-16(27-2)8-5-14/h3-9,11-12H,10H2,1-2H3,(H,22,23,24)