N-(4-butylphenyl)-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(4-butylphenyl)-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(4-butylphenyl)-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(4-butylphenyl)-1-(4-methoxyphenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(4-butylphenyl)-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (4-butylphenyl)-[1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C22H23N5O MolecularWeight: 373.45092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H23N5O/c1-3-4-5-16-6-8-17(9-7-16)26-21-20-14-25-27(22(20)24-15-23-21)18-10-12-19(28-2)13-11-18/h6-15H,3-5H2,1-2H3,(H,23,24,26)